cometadata/datacite-titles-descriptions-related-identifiers huggingface dataset:
DOI: 10.5281/zenodo.2656736
title: S44 | STATINS | Statins Collection from Public Resources

description: A list of statins (lipid-lowering medications) compiled from public resources. Data from CompTox Chemicals Dashboard (STATINS List). Dataset DOI: 10.5281/zenodo.2656736.

Statins, also known as HMG-CoA reductase inhibitors or 3-hydroxy-3-methyl-glutaryl-coenzyme A reductase inhibitors, are a class of lipid-lowering medications. This list has been compiled from information on Wikipedia (https://en.wikipedia.org/wiki/Statin#Available_forms) and PubMed MeSH terms.
DOI: 10.5281/zenodo.2656737
title: S44 | STATINS | Statins Collection from Public Resources

description: A list of statins (lipid-lowering medications) compiled from public resources. Data from CompTox Chemicals Dashboard (STATINS List). Dataset DOI: 10.5281/zenodo.2656736.

Statins, also known as HMG-CoA reductase inhibitors or 3-hydroxy-3-methyl-glutaryl-coenzyme A reductase inhibitors, are a class of lipid-lowering medications. This list has been compiled from information on Wikipedia (https://en.wikipedia.org/wiki/Statin#Available_forms) and PubMed MeSH terms.
DOI: 10.14272/qjvjrwmlfuxgah-qapcuyqasa-n/chmo0000597
title: 19F nuclear magnetic resonance spectroscopy (19F NMR) ()
title: InChI=1S/C18H15FO/c1-18-15(8-9-17(18)20)13-5-3-2-4-12(13)14-7-6-11(19)10-16(14)18/h2-7,10,15H,8-9H2,1H3/t15-,18+/m1/s1

description: dataset for 19F nuclear magnetic resonance spectroscopy (19F NMR)
DOI: 10.14272/qjvjrwmlfuxgah-qapcuyqasa-n/chmo0000595
title: 13C nuclear magnetic resonance spectroscopy (13C NMR) ()
title: InChI=1S/C18H15FO/c1-18-15(8-9-17(18)20)13-5-3-2-4-12(13)14-7-6-11(19)10-16(14)18/h2-7,10,15H,8-9H2,1H3/t15-,18+/m1/s1

description: dataset for 13C nuclear magnetic resonance spectroscopy (13C NMR)
DOI: 10.14272/azoxpipwrdwnba-qhcpkhfhsa-n.1
title: [(2S)-1-benzylpyrrolidin-2-yl]-diphenylmethanol
title: InChI=1S/C24H25NO/c26-24(21-13-6-2-7-14-21,22-15-8-3-9-16-22)23-17-10-18-25(23)19-20-11-4-1-5-12-20/h1-9,11-16,23,26H,10,17-19H2/t23-/m0/s1

description: This is a physical chemical entity[CHEBI_24431] associated with a molecule[CHEBI_25367].
 The molecule[CHEBI_25367] can be described by the following structural desciptors[cheminf_000085]:
 InChI descriptor[cheminf_000113]: InChI=1S/C24H25NO/c26-24(21-13-6-2-7-14-21,22-15-8-3-9-16-22)23-17-10-18-25(23)19-20-11-4-1-5-12-20/h1-9,11-16,23,26H,10,17-19H2/t23-/m0/s1, and canonical SMILES descriptor[cheminf_000007]: OC([C@@H]1CCCN1Cc1ccccc1)(c1ccccc1)c1ccccc1, and by the IUPAC name[cheminf_000107]: [(2S)-1-benzylpyrrolidin-2-yl]-diphenylmethanol.
 
 The physical chemical entity[CHEBI_24431] has a component solvent[CHEBI_46787] which is described by the canonical SMILES descriptor[cheminf_000007]:
 
 The physical chemical entity[CHEBI_24431] has the following Sample ID as registered in the research data repository chemotion (www.chemotion-repository.net, https://doi.org/10.25504/FAIRsharing.iagXcR): CRS-57416

 The physical chemical entity[CHEBI_24431] can be described by the physical descriptors [CHEMINF_000025]:
 Melting point descriptor[CHEMINF_000256]: 
 Boiling point descriptor[CHEMINF_000257]: 
 Refractive index descriptor[CHEMINF_000253]:

 The physical chemical entity[CHEBI_24431] can be further described by the following assays[OBI:0000070][CHMO:0001133]:
 
 CHMO:0000593 | 1H nuclear magnetic resonance spectroscopy (1H NMR)
 
 The physical chemical entity[CHEBI_24431] was deposited to the Molecule Archive of the Karlsruhe Insitute of Technology (KIT) with the following Sample ID: 

 Used ontologies:
 CHEBI - Chemical Entities of Biological Interest
 CHEMINF - chemical information ontology (information entities about chemical entities)
 CHMO - Chemical Methods Ontology
 OBI - Ontology for Biomedical Investigations
DOI: 10.14272/azoxpipwrdwnba-qhcpkhfhsa-n/chmo0000593
title: 1H nuclear magnetic resonance spectroscopy (1H NMR) ([(2S)-1-benzylpyrrolidin-2-yl]-diphenylmethanol)
title: InChI=1S/C24H25NO/c26-24(21-13-6-2-7-14-21,22-15-8-3-9-16-22)23-17-10-18-25(23)19-20-11-4-1-5-12-20/h1-9,11-16,23,26H,10,17-19H2/t23-/m0/s1

description: dataset for 1H nuclear magnetic resonance spectroscopy (1H NMR)
DOI: 10.14272/sfwavjvilkduqg-sjlpkxtdsa-n/chmo0002136.1
title: chiral stationary phase high-performance liquid chromatography (CSP HPLC) ()
title: InChI=1S/C18H16O/c1-18-15-9-5-4-8-13(15)12-6-2-3-7-14(12)16(18)10-11-17(18)19/h2-9,16H,10-11H2,1H3/t16-,18-/m1/s1

description: dataset for chiral stationary phase high-performance liquid chromatography (CSP HPLC)
DOI: 10.14272/sfwavjvilkduqg-sjlpkxtdsa-n/chmo0000593.1
title: 1H nuclear magnetic resonance spectroscopy (1H NMR) ()
title: InChI=1S/C18H16O/c1-18-15-9-5-4-8-13(15)12-6-2-3-7-14(12)16(18)10-11-17(18)19/h2-9,16H,10-11H2,1H3/t16-,18-/m1/s1

description: dataset for 1H nuclear magnetic resonance spectroscopy (1H NMR)
DOI: 10.14272/sfwavjvilkduqg-sjlpkxtdsa-n.2
title: (3aR,11bS)-11b-methyl-2,3,3a,11b-tetrahydro-1H-cyclopenta[l]phenanthren-1-one
title: InChI=1S/C18H16O/c1-18-15-9-5-4-8-13(15)12-6-2-3-7-14(12)16(18)10-11-17(18)19/h2-9,16H,10-11H2,1H3/t16-,18-/m1/s1

description: This is a physical chemical entity[CHEBI_24431] associated with a molecule[CHEBI_25367].
 The molecule[CHEBI_25367] can be described by the following structural desciptors[cheminf_000085]:
 InChI descriptor[cheminf_000113]: InChI=1S/C18H16O/c1-18-15-9-5-4-8-13(15)12-6-2-3-7-14(12)16(18)10-11-17(18)19/h2-9,16H,10-11H2,1H3/t16-,18-/m1/s1, and canonical SMILES descriptor[cheminf_000007]: O=C1CC[C@H]2[C@@]1(C)c1ccccc1-c1c2cccc1, and by the IUPAC name[cheminf_000107]: .
 
 The physical chemical entity[CHEBI_24431] has a component solvent[CHEBI_46787] which is described by the canonical SMILES descriptor[cheminf_000007]:
 
 The physical chemical entity[CHEBI_24431] has the following Sample ID as registered in the research data repository chemotion (www.chemotion-repository.net, https://doi.org/10.25504/FAIRsharing.iagXcR): CRS-57438

 The physical chemical entity[CHEBI_24431] can be described by the physical descriptors [CHEMINF_000025]:
 Melting point descriptor[CHEMINF_000256]: 
 Boiling point descriptor[CHEMINF_000257]: 
 Refractive index descriptor[CHEMINF_000253]:

 The physical chemical entity[CHEBI_24431] can be further described by the following assays[OBI:0000070][CHMO:0001133]:
 
 CHMO:0000593 | 1H nuclear magnetic resonance spectroscopy (1H NMR)
 
 CHMO:0002136 | chiral stationary phase high-performance liquid chromatography (CSP HPLC)
 
 The physical chemical entity[CHEBI_24431] was deposited to the Molecule Archive of the Karlsruhe Insitute of Technology (KIT) with the following Sample ID: 

 Used ontologies:
 CHEBI - Chemical Entities of Biological Interest
 CHEMINF - chemical information ontology (information entities about chemical entities)
 CHMO - Chemical Methods Ontology
 OBI - Ontology for Biomedical Investigations
DOI: 10.14272/dkvrpxddhnzjkr-rsqmyvmbsa-n/chmo0000595
title: 13C nuclear magnetic resonance spectroscopy (13C NMR) ()
title: InChI=1S/C28H25F3O3/c1-26-22-15-9-8-14-20(22)19-12-6-7-13-21(19)23(26)16-17-24(26)34-25(32)27(33-2,28(29,30)31)18-10-4-3-5-11-18/h3-15,23-24H,16-17H2,1-2H3/t23-,24-,26-,27+/m1/s1

description: dataset for 13C nuclear magnetic resonance spectroscopy (13C NMR)
DOI: 10.14272/dkvrpxddhnzjkr-rsqmyvmbsa-n/chmo0000763
title: attenuated total reflectance Fourier transform infrared spectroscopy (ATR-FTIR) ()
title: InChI=1S/C28H25F3O3/c1-26-22-15-9-8-14-20(22)19-12-6-7-13-21(19)23(26)16-17-24(26)34-25(32)27(33-2,28(29,30)31)18-10-4-3-5-11-18/h3-15,23-24H,16-17H2,1-2H3/t23-,24-,26-,27+/m1/s1

description: dataset for attenuated total reflectance Fourier transform infrared spectroscopy (ATR-FTIR)
DOI: 10.14272/dkvrpxddhnzjkr-rsqmyvmbsa-n.1
title: (1R,3aR,11bS)-11b-methyl-2,3,3a,11b-tetrahydro-1H-cyclopenta[l]phenanthren-1-yl (S)-3,3,3-trifluoro-2-methoxy-2-phenylpropanoate
title: InChI=1S/C28H25F3O3/c1-26-22-15-9-8-14-20(22)19-12-6-7-13-21(19)23(26)16-17-24(26)34-25(32)27(33-2,28(29,30)31)18-10-4-3-5-11-18/h3-15,23-24H,16-17H2,1-2H3/t23-,24-,26-,27+/m1/s1

description: This is a physical chemical entity[CHEBI_24431] associated with a molecule[CHEBI_25367].
 The molecule[CHEBI_25367] can be described by the following structural desciptors[cheminf_000085]:
 InChI descriptor[cheminf_000113]: InChI=1S/C28H25F3O3/c1-26-22-15-9-8-14-20(22)19-12-6-7-13-21(19)23(26)16-17-24(26)34-25(32)27(33-2,28(29,30)31)18-10-4-3-5-11-18/h3-15,23-24H,16-17H2,1-2H3/t23-,24-,26-,27+/m1/s1, and canonical SMILES descriptor[cheminf_000007]: CO[C@@](C(F)(F)F)(c1ccccc1)C(=O)O[C@@H]1CC[C@H]2[C@@]1(C)c1ccccc1-c1c2cccc1, and by the IUPAC name[cheminf_000107]: .
 
 The physical chemical entity[CHEBI_24431] has a component solvent[CHEBI_46787] which is described by the canonical SMILES descriptor[cheminf_000007]:
 
 The physical chemical entity[CHEBI_24431] has the following Sample ID as registered in the research data repository chemotion (www.chemotion-repository.net, https://doi.org/10.25504/FAIRsharing.iagXcR): CRS-57745

 The physical chemical entity[CHEBI_24431] can be described by the physical descriptors [CHEMINF_000025]:
 Melting point descriptor[CHEMINF_000256]: 
 Boiling point descriptor[CHEMINF_000257]: 
 Refractive index descriptor[CHEMINF_000253]:

 The physical chemical entity[CHEBI_24431] can be further described by the following assays[OBI:0000070][CHMO:0001133]:
 
 CHMO:0000498 | high-resolution mass spectrometry (HRMS)
 
 CHMO:0000593 | 1H nuclear magnetic resonance spectroscopy (1H NMR)
 
 CHMO:0000595 | 13C nuclear magnetic resonance spectroscopy (13C NMR)
 
 CHMO:0000763 | attenuated total reflectance Fourier transform infrared spectroscopy (ATR-FTIR)
 
 The physical chemical entity[CHEBI_24431] was deposited to the Molecule Archive of the Karlsruhe Insitute of Technology (KIT) with the following Sample ID: 

 Used ontologies:
 CHEBI - Chemical Entities of Biological Interest
 CHEMINF - chemical information ontology (information entities about chemical entities)
 CHMO - Chemical Methods Ontology
 OBI - Ontology for Biomedical Investigations
DOI: 10.14272/dkvrpxddhnzjkr-rsqmyvmbsa-n/chmo0000593
title: 1H nuclear magnetic resonance spectroscopy (1H NMR) ()
title: InChI=1S/C28H25F3O3/c1-26-22-15-9-8-14-20(22)19-12-6-7-13-21(19)23(26)16-17-24(26)34-25(32)27(33-2,28(29,30)31)18-10-4-3-5-11-18/h3-15,23-24H,16-17H2,1-2H3/t23-,24-,26-,27+/m1/s1

description: dataset for 1H nuclear magnetic resonance spectroscopy (1H NMR)
DOI: 10.14272/dkvrpxddhnzjkr-rsqmyvmbsa-n/chmo0000498
title: high-resolution mass spectrometry (HRMS) ()
title: InChI=1S/C28H25F3O3/c1-26-22-15-9-8-14-20(22)19-12-6-7-13-21(19)23(26)16-17-24(26)34-25(32)27(33-2,28(29,30)31)18-10-4-3-5-11-18/h3-15,23-24H,16-17H2,1-2H3/t23-,24-,26-,27+/m1/s1

description: dataset for high-resolution mass spectrometry (HRMS)
DOI: 10.14272/fyakyfioojbfhv-vdkikqqvsa-n/chmo0002136.1
title: chiral stationary phase high-performance liquid chromatography (CSP HPLC) ()
title: InChI=1S/C25H21BrO2/c1-25-21-9-5-4-8-19(21)18-6-2-3-7-20(18)22(25)14-15-23(25)28-24(27)16-10-12-17(26)13-11-16/h2-13,22-23H,14-15H2,1H3/t22-,23-,25-/m1/s1

description: dataset for chiral stationary phase high-performance liquid chromatography (CSP HPLC)
DOI: 10.14272/fyakyfioojbfhv-vdkikqqvsa-n/chmo0000498
title: high-resolution mass spectrometry (HRMS) ()
title: InChI=1S/C25H21BrO2/c1-25-21-9-5-4-8-19(21)18-6-2-3-7-20(18)22(25)14-15-23(25)28-24(27)16-10-12-17(26)13-11-16/h2-13,22-23H,14-15H2,1H3/t22-,23-,25-/m1/s1

description: dataset for high-resolution mass spectrometry (HRMS)
DOI: 10.14272/fyakyfioojbfhv-vdkikqqvsa-n/chmo0002136
title: chiral stationary phase high-performance liquid chromatography (CSP HPLC) ()
title: InChI=1S/C25H21BrO2/c1-25-21-9-5-4-8-19(21)18-6-2-3-7-20(18)22(25)14-15-23(25)28-24(27)16-10-12-17(26)13-11-16/h2-13,22-23H,14-15H2,1H3/t22-,23-,25-/m1/s1

description: dataset for chiral stationary phase high-performance liquid chromatography (CSP HPLC)
DOI: 10.14272/fyakyfioojbfhv-vdkikqqvsa-n/chmo0000763
title: attenuated total reflectance Fourier transform infrared spectroscopy (ATR-FTIR) ()
title: InChI=1S/C25H21BrO2/c1-25-21-9-5-4-8-19(21)18-6-2-3-7-20(18)22(25)14-15-23(25)28-24(27)16-10-12-17(26)13-11-16/h2-13,22-23H,14-15H2,1H3/t22-,23-,25-/m1/s1

description: dataset for attenuated total reflectance Fourier transform infrared spectroscopy (ATR-FTIR)
DOI: 10.14272/fyakyfioojbfhv-vdkikqqvsa-n.1
title: (1R,3aR,11bS)-11b-methyl-2,3,3a,11b-tetrahydro-1H-cyclopenta[l]phenanthren-1-yl 4-bromobenzoate
title: InChI=1S/C25H21BrO2/c1-25-21-9-5-4-8-19(21)18-6-2-3-7-20(18)22(25)14-15-23(25)28-24(27)16-10-12-17(26)13-11-16/h2-13,22-23H,14-15H2,1H3/t22-,23-,25-/m1/s1

description: This is a physical chemical entity[CHEBI_24431] associated with a molecule[CHEBI_25367].
 The molecule[CHEBI_25367] can be described by the following structural desciptors[cheminf_000085]:
 InChI descriptor[cheminf_000113]: InChI=1S/C25H21BrO2/c1-25-21-9-5-4-8-19(21)18-6-2-3-7-20(18)22(25)14-15-23(25)28-24(27)16-10-12-17(26)13-11-16/h2-13,22-23H,14-15H2,1H3/t22-,23-,25-/m1/s1, and canonical SMILES descriptor[cheminf_000007]: Brc1ccc(cc1)C(=O)O[C@@H]1CC[C@H]2[C@@]1(C)c1ccccc1-c1c2cccc1, and by the IUPAC name[cheminf_000107]: .
 
 The physical chemical entity[CHEBI_24431] has a component solvent[CHEBI_46787] which is described by the canonical SMILES descriptor[cheminf_000007]:
 
 The physical chemical entity[CHEBI_24431] has the following Sample ID as registered in the research data repository chemotion (www.chemotion-repository.net, https://doi.org/10.25504/FAIRsharing.iagXcR): CRS-57739

 The physical chemical entity[CHEBI_24431] can be described by the physical descriptors [CHEMINF_000025]:
 Melting point descriptor[CHEMINF_000256]: 
 Boiling point descriptor[CHEMINF_000257]: 
 Refractive index descriptor[CHEMINF_000253]:

 The physical chemical entity[CHEBI_24431] can be further described by the following assays[OBI:0000070][CHMO:0001133]:
 
 CHMO:0000593 | 1H nuclear magnetic resonance spectroscopy (1H NMR)
 
 CHMO:0002136 | chiral stationary phase high-performance liquid chromatography (CSP HPLC)
 
 CHMO:0000595 | 13C nuclear magnetic resonance spectroscopy (13C NMR)
 
 CHMO:0002136 | chiral stationary phase high-performance liquid chromatography (CSP HPLC)
 
 CHMO:0000498 | high-resolution mass spectrometry (HRMS)
 
 CHMO:0000156 | X-ray diffraction (XRD)
 
 CHMO:0000763 | attenuated total reflectance Fourier transform infrared spectroscopy (ATR-FTIR)
 
 The physical chemical entity[CHEBI_24431] was deposited to the Molecule Archive of the Karlsruhe Insitute of Technology (KIT) with the following Sample ID: 

 Used ontologies:
 CHEBI - Chemical Entities of Biological Interest
 CHEMINF - chemical information ontology (information entities about chemical entities)
 CHMO - Chemical Methods Ontology
 OBI - Ontology for Biomedical Investigations
DOI: 10.14272/fyakyfioojbfhv-vdkikqqvsa-n/chmo0000593
title: 1H nuclear magnetic resonance spectroscopy (1H NMR) ()
title: InChI=1S/C25H21BrO2/c1-25-21-9-5-4-8-19(21)18-6-2-3-7-20(18)22(25)14-15-23(25)28-24(27)16-10-12-17(26)13-11-16/h2-13,22-23H,14-15H2,1H3/t22-,23-,25-/m1/s1

description: dataset for 1H nuclear magnetic resonance spectroscopy (1H NMR)
DOI: 10.14272/fyakyfioojbfhv-vdkikqqvsa-n/chmo0000156
title: X-ray diffraction (XRD) ()
title: InChI=1S/C25H21BrO2/c1-25-21-9-5-4-8-19(21)18-6-2-3-7-20(18)22(25)14-15-23(25)28-24(27)16-10-12-17(26)13-11-16/h2-13,22-23H,14-15H2,1H3/t22-,23-,25-/m1/s1

description: dataset for X-ray diffraction (XRD)
DOI: 10.14272/fyakyfioojbfhv-vdkikqqvsa-n/chmo0000595
title: 13C nuclear magnetic resonance spectroscopy (13C NMR) ()
title: InChI=1S/C25H21BrO2/c1-25-21-9-5-4-8-19(21)18-6-2-3-7-20(18)22(25)14-15-23(25)28-24(27)16-10-12-17(26)13-11-16/h2-13,22-23H,14-15H2,1H3/t22-,23-,25-/m1/s1

description: dataset for 13C nuclear magnetic resonance spectroscopy (13C NMR)
DOI: 10.14272/ypzzkcaaahbqky-kznaepcwsa-n/chmo0000595
title: 13C nuclear magnetic resonance spectroscopy (13C NMR) ()
title: InChI=1S/C18H18O/c1-18-15-9-5-4-8-13(15)12-6-2-3-7-14(12)16(18)10-11-17(18)19/h2-9,16-17,19H,10-11H2,1H3/t16-,17-,18-/m1/s1

description: dataset for 13C nuclear magnetic resonance spectroscopy (13C NMR)
DOI: 10.14272/ypzzkcaaahbqky-kznaepcwsa-n/chmo0000763
title: attenuated total reflectance Fourier transform infrared spectroscopy (ATR-FTIR) ()
title: InChI=1S/C18H18O/c1-18-15-9-5-4-8-13(15)12-6-2-3-7-14(12)16(18)10-11-17(18)19/h2-9,16-17,19H,10-11H2,1H3/t16-,17-,18-/m1/s1

description: dataset for attenuated total reflectance Fourier transform infrared spectroscopy (ATR-FTIR)
DOI: 10.14272/ypzzkcaaahbqky-kznaepcwsa-n.1
title: (1R,3aR,11bS)-11b-methyl-2,3,3a,11b-tetrahydro-1H-cyclopenta[l]phenanthren-1-ol
title: InChI=1S/C18H18O/c1-18-15-9-5-4-8-13(15)12-6-2-3-7-14(12)16(18)10-11-17(18)19/h2-9,16-17,19H,10-11H2,1H3/t16-,17-,18-/m1/s1

description: This is a physical chemical entity[CHEBI_24431] associated with a molecule[CHEBI_25367].
 The molecule[CHEBI_25367] can be described by the following structural desciptors[cheminf_000085]:
 InChI descriptor[cheminf_000113]: InChI=1S/C18H18O/c1-18-15-9-5-4-8-13(15)12-6-2-3-7-14(12)16(18)10-11-17(18)19/h2-9,16-17,19H,10-11H2,1H3/t16-,17-,18-/m1/s1, and canonical SMILES descriptor[cheminf_000007]: O[C@@H]1CC[C@H]2[C@@]1(C)c1ccccc1-c1c2cccc1, and by the IUPAC name[cheminf_000107]: .
 
 The physical chemical entity[CHEBI_24431] has a component solvent[CHEBI_46787] which is described by the canonical SMILES descriptor[cheminf_000007]:
 
 The physical chemical entity[CHEBI_24431] has the following Sample ID as registered in the research data repository chemotion (www.chemotion-repository.net, https://doi.org/10.25504/FAIRsharing.iagXcR): CRS-57730

 The physical chemical entity[CHEBI_24431] can be described by the physical descriptors [CHEMINF_000025]:
 Melting point descriptor[CHEMINF_000256]: 
 Boiling point descriptor[CHEMINF_000257]: 
 Refractive index descriptor[CHEMINF_000253]:

 The physical chemical entity[CHEBI_24431] can be further described by the following assays[OBI:0000070][CHMO:0001133]:
 
 CHMO:0000763 | attenuated total reflectance Fourier transform infrared spectroscopy (ATR-FTIR)
 
 CHMO:0000593 | 1H nuclear magnetic resonance spectroscopy (1H NMR)
 
 CHMO:0000595 | 13C nuclear magnetic resonance spectroscopy (13C NMR)
 
 The physical chemical entity[CHEBI_24431] was deposited to the Molecule Archive of the Karlsruhe Insitute of Technology (KIT) with the following Sample ID: 

 Used ontologies:
 CHEBI - Chemical Entities of Biological Interest
 CHEMINF - chemical information ontology (information entities about chemical entities)
 CHMO - Chemical Methods Ontology
 OBI - Ontology for Biomedical Investigations
DOI: 10.14272/ypzzkcaaahbqky-kznaepcwsa-n/chmo0000593
title: 1H nuclear magnetic resonance spectroscopy (1H NMR) ()
title: InChI=1S/C18H18O/c1-18-15-9-5-4-8-13(15)12-6-2-3-7-14(12)16(18)10-11-17(18)19/h2-9,16-17,19H,10-11H2,1H3/t16-,17-,18-/m1/s1

description: dataset for 1H nuclear magnetic resonance spectroscopy (1H NMR)
DOI: 10.34740/kaggle/dsv/13848570
title: Peer-to-Peer Boliviano (BOB) Exchange Data
DOI: 10.14272/tvohltaxlcgbie-apwzrjjasa-n/chmo0000498
title: high-resolution mass spectrometry (HRMS) ()
title: InChI=1S/C19H18O2/c1-19-16(9-10-18(19)20)14-6-4-3-5-13(14)15-11-12(21-2)7-8-17(15)19/h3-8,11,16H,9-10H2,1-2H3/t16-,19+/m1/s1

description: dataset for high-resolution mass spectrometry (HRMS)
DOI: 10.14272/tvohltaxlcgbie-apwzrjjasa-n/chmo0000593
title: 1H nuclear magnetic resonance spectroscopy (1H NMR) ()
title: InChI=1S/C19H18O2/c1-19-16(9-10-18(19)20)14-6-4-3-5-13(14)15-11-12(21-2)7-8-17(15)19/h3-8,11,16H,9-10H2,1-2H3/t16-,19+/m1/s1

description: dataset for 1H nuclear magnetic resonance spectroscopy (1H NMR)
DOI: 10.14272/fxeiypliojmnmu-dnvcbolysa-n/chmo0000763
title: attenuated total reflectance Fourier transform infrared spectroscopy (ATR-FTIR) ()
title: InChI=1S/C19H18O2/c1-19-15(10-11-17(19)20)13-7-4-3-6-12(13)14-8-5-9-16(21-2)18(14)19/h3-9,15H,10-11H2,1-2H3/t15-,19-/m1/s1

description: dataset for attenuated total reflectance Fourier transform infrared spectroscopy (ATR-FTIR)
DOI: 10.14272/fxeiypliojmnmu-dnvcbolysa-n/chmo0002136
title: chiral stationary phase high-performance liquid chromatography (CSP HPLC) ()
title: InChI=1S/C19H18O2/c1-19-15(10-11-17(19)20)13-7-4-3-6-12(13)14-8-5-9-16(21-2)18(14)19/h3-9,15H,10-11H2,1-2H3/t15-,19-/m1/s1

description: dataset for chiral stationary phase high-performance liquid chromatography (CSP HPLC)
DOI: 10.14272/tvohltaxlcgbie-apwzrjjasa-n/chmo0000595
title: 13C nuclear magnetic resonance spectroscopy (13C NMR) ()
title: InChI=1S/C19H18O2/c1-19-16(9-10-18(19)20)14-6-4-3-5-13(14)15-11-12(21-2)7-8-17(15)19/h3-8,11,16H,9-10H2,1-2H3/t16-,19+/m1/s1

description: dataset for 13C nuclear magnetic resonance spectroscopy (13C NMR)
DOI: 10.14272/tvohltaxlcgbie-apwzrjjasa-n/chmo0000763
title: attenuated total reflectance Fourier transform infrared spectroscopy (ATR-FTIR) ()
title: InChI=1S/C19H18O2/c1-19-16(9-10-18(19)20)14-6-4-3-5-13(14)15-11-12(21-2)7-8-17(15)19/h3-8,11,16H,9-10H2,1-2H3/t16-,19+/m1/s1

description: dataset for attenuated total reflectance Fourier transform infrared spectroscopy (ATR-FTIR)
DOI: 10.14272/fxeiypliojmnmu-dnvcbolysa-n/chmo0000498
title: high-resolution mass spectrometry (HRMS) ()
title: InChI=1S/C19H18O2/c1-19-15(10-11-17(19)20)13-7-4-3-6-12(13)14-8-5-9-16(21-2)18(14)19/h3-9,15H,10-11H2,1-2H3/t15-,19-/m1/s1

description: dataset for high-resolution mass spectrometry (HRMS)
DOI: 10.14272/fxeiypliojmnmu-dnvcbolysa-n/chmo0000595
title: 13C nuclear magnetic resonance spectroscopy (13C NMR) ()
title: InChI=1S/C19H18O2/c1-19-15(10-11-17(19)20)13-7-4-3-6-12(13)14-8-5-9-16(21-2)18(14)19/h3-9,15H,10-11H2,1-2H3/t15-,19-/m1/s1

description: dataset for 13C nuclear magnetic resonance spectroscopy (13C NMR)
DOI: 10.14272/fxeiypliojmnmu-dnvcbolysa-n/chmo0000593
title: 1H nuclear magnetic resonance spectroscopy (1H NMR) ()
title: InChI=1S/C19H18O2/c1-19-15(10-11-17(19)20)13-7-4-3-6-12(13)14-8-5-9-16(21-2)18(14)19/h3-9,15H,10-11H2,1-2H3/t15-,19-/m1/s1

description: dataset for 1H nuclear magnetic resonance spectroscopy (1H NMR)