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Methyl isothiocyanatidocarbonate
SpectraBase Compound ID 8ixkyLX2VtS
InChI InChI=1S/C3H3NO2S/c1-6-3(5)4-2-7/h1H3
InChIKey LBFAAYMITJMZOC-UHFFFAOYSA-N
Mol Weight 117.12 g/mol
Molecular Formula C3H3NO2S
Exact Mass 116.98845 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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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