SDBS-NMR-HSP-04-866
Title
SDBS-NMR-HSP-04-866
Subtitle
1H NMR spectrum of caffeine
Type
data
Subject
Spectral data
Spectral Code
NMR-HSP-04-866
DOI

URL
https://sdbs.db.aist.go.jp/sdbs/cgi-bin/landingpage?spcode=NMR-HSP-04-866
Description
Spectral Type
1H NMR
Sample: Compound Name
caffeine
Sample: Molecular Formula
C8H10N4O2
Sample: Molecular Weight
194.2
Sample: SDBS No
1898
Sample: InChI
InChI=1S/C8H10N4O2/c1-10-4-9-6-5(10)7(13)12(3)8(14)11(6)2/h4H,1-3H3
Sample: InChIKey
RYYVLZVUVIJVGH-UHFFFAOYSA-N
Sample: RN
58-08-2
Measurement Conditions
89.56 MHz
0.028 g : 0.5 ml D2O
Related pages
Collection of Spectral data SDBS-1898
Mass SDBS-MS2006-03097WA
13C NMR SDBS-NMR-CDS-06-784
1H NMR SDBS-NMR-HSP-04-064
1H NMR SDBS-HR2006-00973NS
IR SDBS-IR-NIDA-60985
IR SDBS-IR-NIDA-62055
Publisher
National Institute of Advanced Industrial Science and Technology (AIST)
Rights
AIST all rights reserved
Date of Publication
1999-03-31
Update History


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