/NMRPz7Yf[T/_YbWT/-2

/NMRz(/c@Nbgh)0 '%(Z:%c,)
S = I(I+1)ν03N

I : /mrw
ν0 : O5+N : /mrw:%.

B8(2020/5/12)

D$ (line width factor)
LW =(2I + 3)Q2
I2(2I – 1)

I : /mrw
Q : /1uytwq?!'%(13C/j8)
R’ =I ( I + 1)
1 1( + 1)
2 2×

ν03

gW >XihI=1/2c/15N (0.37%), 19F (100%), 29Si (4.7%), 31P (100%)

ν13C

77Se (7.58%), 111Cd (12.75%), 119Sn (8.58%)

C?!'%(;3eE(Y^13C/j8)
R’ =I ( I + 1)
1 1( + 1)
2 2×

ν0
ν13C

3×α0α13C

125Te (6.99%), 195Pt (33.8%), 207Pb (22.6%)

gW >XihI=1/2c/2H (I = 1, 0.015%), 7Li (I = 3/2, 92.6%)
11B (I = 3/2, 81.2%), 14N (I = 1, 99.6%)
17O (I = 5/2, 0.037%)

c/_ckosvwlVgW >Xih/
103Rh (I = –1/2, 100%)

107Ag (I = –1/2, 51.82%), 109Ag (I = –1/2, 48.18%)

 <R/@c96UgdNMRS
" K, 4L , " M& FQA*xG" # H
ISBN: 9784782705681/mrwf'%Q\i]ic/c8=Ia`cpynV+)J

1NMR+Y8G9GAA*>
*B5>@C;=-F(AJSVLXΔE = hν>7F>
γ ·B0
ν=2π

NTPB5>@?F
1H ~ 15 ppm

13C ~ 200 ppm
11B ~ 210 ppm

 @!.KXPOUXRWMB
4A*I%7F

31P ~ 450 ppm

8G9GA@03F*(1HI100 MHz>6:>2)

http://www.chem.wisc.edu/areas/reich/nmr/notes-7-multi.pdf'B)AI1H@6=
I-H-H$ 7F4>1 (=19F ABOUXRWMI1H@7)

*A)-Z high frequency

NTP

77Se ~ 3000 ppm

195Pt ~ 6700 ppm

59Co ~ 18000 ppm

 NTP A-B
 I /?1DNMQVI#<3F"1,F(E&6@7F4>)

*A-
Z low frequency

2NMR&D2H NMR7=48@
2H, 7;BI = 1, 0.015%, "'γ = 4.1066
?C>B8 = 2.8+10–3, !$ = 1.45+10–6D)*#-1.8/7=48@
1H NMR spectrum (C D )
6 6

5<8

0Si(CD3)4 = 0

Dstyrene-d8/MeReO32,.
%
6:9A35(2H NMR spectrum (C D )6 6J. Mol. Cat. B: Enzymatic 2011, 73, 17.
Chem. Commun. 2002, 66.

3NMR*K7Li, 6Li NMR:C8>F
7Li, :@II = 3/2,

 92.6%, #+γ = 10.396
EJDI> = –4.10–2, "& = 1.54.103
6Li, :@II = 1,

 7.4%, #+γ = 3.937
EJDI> = –8.10–4, "& = 3.58
7Li!KMe Si7;=GI2'BH>I63

RI(rapid injection)NMR0,-E?<J9A> 3LiCl/D2O = 0$ 3%–10~5 ppm

6Li!K(Ph6Li) 1(Ph6Li) 2246
(6Et2O2 Li/5413C NMR:C8>F0)

Prof. Hans J. Reich@U Wisconsin

J. Am. Chem. Soc. 2007, 129, 3492.

J. Am. Chem. Soc. 1998, 120, 7201.

4

NMR

2X11B NMRFMCIS

11B, FJTI = 3/2, &"80.42%, ,#4"γ = 8.5847

EKI%>BF3·OEt2 = 0->.–120~90 ppm

PUOTI = 4.1810–2, +0  = 7.528102

XBBr3: 38.5 ppm, BBr3·pyridine: –7.1 ppm
=;=BHLRTD>V6YW6
NA/CQFGU:> 11B NMR9*
11B NMR:$/ 1 7=
@53Energy Environ. Sci. 2009, 2, 706.

(!<)=11B@δB 39

Science 2012, 336, 1420.

? 'δB 47

δB 12.5

Science 2006, 314, 113.

Science 2011, 333, 610.
DurEt3P
Et3P

PtB
B

3

http://u-of-o-nmr-facility.blogspot.jp/2008/04/11-b-cosy.html
http://u-of-o-nmr-facility.blogspot.jp/2008/04/1-h-11-b-hmqc.html

δB 17

Science 2010, 328, 345.

δB 130

DurNat. Chem. 2013, 5, 115.

5

NMR&;15N NMR15/28
15N, 139I = –1/2, 0.37%,  'γ = –2.716
7:692 = ,+, % = 2.19*10–2

042 .CH3NO2 = 0" .#–600~600 ppm

(-;!$)-

1H-15N HSQC

NNPP NαNPNNPN Mo N N Mo NNβN

P = PiPr2

δN –29.0(dt, 1JNN&2JPN = 6.1&2.4 Hz, terminal Nα)
δN –16.5(d, 1JNN = 6.1 Hz, terminal Nβ)
δN 8.5(s, bridging N)
Nat. Chem. 2011, 3, 120.

6

NMR/P19F NMR?F=BM100%, (! 0 γ = 25.1815
KOJNB = 75, ', = 4.733103

19N, ?DNI = 1/2, $

%P EA+GLHO92.
http://www.cerij.or.jp/

>EB#:CFCl3 = 0) :*–300~900 ppm

19%PC@I9-&8F-cytosine<"469;;F-uracil<19F NMRP
BA5-FC

5-FC

5-FU

5-FU
510

http://www.toray-research.co.jp/new_bunseki/index.html

50432
10-1
Chemical shift (ppm)−5−10−15
Chemical shift (ppm)−20

Brit. J. Cancer 2004, 89, 1796.

-2−257

NMR0T29Si NMRELBHP29Si, EJRI = –1/2, $

!4.7%, +" 1!γ = –5.3190
NSMRH = 75, *. = 4.95410–1

DKH#:SiMe4 = 0, :-–200~100 ppm)T 29Si NMR8<=Al,SiG@O?H929T& 7(929Si>;%http://www.ube-ind.co.jp/usal/documents/o224_145.htm

δSi 90Science 2004, 305, 1755.

)TISF/3856
DQACR9'δSi –52, –50, 300, 308

Science 2011, 331, 1306.

Sci. Rep. 2012, 2, 564.

8

NMR131P NMR'+%(.
31P, ')/I = 1/2,

 100%,  γ = 10.8394
 -0,/( = #",  = 1.44!102

&*( $85%H3PO4 = 0
$–400~600 ppm

1Ph(a) 1 + xantphos (1 eq), 80 °C, 15 min, in C6D6, under H2/CO (1/1, 0.1 MPa)

10 OPhPRuPPPhPhOPhCOCOPhPhPhRu
PCOCOδP ෥22.2

10

δP 38.8(b) 1 + xantphos (1 eq), 120 °C, 15 min, in DMA, under H2/CO (1/1, 0.1 MPa)(c) Rh(acac)(CO)2 + xantphos (1 eq) + 1 (2.5 eq), 120 °C, 15 min, in DMA, under H2/CO (1/1, 0.1 MPa)
Ph2PH
P

PPh2ORhCOP

1J7CO
δP 19.2=122HzRhPδP ෥17.7
free xantphos(d) Rh(acac)(CO)2 + xantphos (1 eq), 120 °C, 15 min, in DMA, under H2/CO (1/1, 0.1 MPa)O

two unidentified doublets
δP 0.7, J = 148 HzO
δP 8.1, J = 135 Hz

CORh
P12COP

Ar = 4-nitrophenyl(e) Rh(acac)(CO)2 + xantphos (1 eq), 120 °C, 15 min, in DMA, under CO (0.1 MPa)(f) Rh(acac)(CO)2 + xantphos (1 eq), 80 °C, 15 min, in C6D6, under H2/CO (1/1, 0.1 MPa)(g) Rh(acac)(CO)2 + xantphos (1 eq), 120 °C, 15 min, in DMA, under Ar (0.1 MPa)
COOO
CORh
Rh PO
PO
P11'P11COO
Rh
O

Fig. 4 31P NMR traces for the time course of transesterification ofp-nitrophenyl uridine H-phosphonate 4a with EtOH (5 equiv.). Notethe immediate consumption of LP-4a in the first minute of the reaction.

PP
11PPM

40.0

30.0

31

20.0

10.0

0.0

-10.0

Angew. Chem. Int. Ed. 2010, 49, 4488.

-20.0

New J. Chem. 2010, 34, 854.

9