SpectraBase Spectrum ID |
7Q23UIB2J2H |
Name |
CARBON(ISOTHIOCYANATIDIC) ACID, METHYL ESTER |
Copyright |
Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
Exact Mass |
116.988449513 u |
Formula |
C3H3NO2S |
InChI |
InChI=1S/C3H3NO2S/c1-6-3(5)4-2-7/h1H3 |
InChIKey |
LBFAAYMITJMZOC-UHFFFAOYSA-N |
Molecular Weight |
117.122 g/mol |
Nominal Mass |
117 u |
Number of Peaks |
31 |
SMILES |
COC(N=C=S)=O |
SPLASH |
splash10-05fr-9000000000-2a40dd3311b23f87a3da |
Source of Spectrum |
Chemical Concepts, A Wiley Division, Weinheim, Germany |
Wiley ID |
MVX_000117 |