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isothiocyanatoformic acid, ethyl ester
SpectraBase Compound ID 37H5p7gH5wL
InChI InChI=1S/C4H5NO2S/c1-2-7-4(6)5-3-8/h2H2,1H3
InChIKey BDTDECDAHYOJRO-UHFFFAOYSA-N
Mol Weight 131.15 g/mol
Molecular Formula C4H5NO2S
Exact Mass 131.0041 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IxluWcnrhpB
Name Ethyl isothiocyanatidocarbonate
CAS Registry Number 16182-04-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C4H5NO2S
InChI InChI=1S/C4H5NO2S/c1-2-7-4(6)5-3-8/h2H2,1H3
InChIKey BDTDECDAHYOJRO-UHFFFAOYSA-N
Molecular Weight 131.149 g/mol
SMILES C(N=C=S)(=O)OCC
SPLASH splash10-056r-9000000000-dffef93e5251f1114352
Source of Spectrum PG-1982-773-0
Synonyms Carbethoxy isothiocyanate Carbon(isothiocyanatidic) acid, ethyl ester Ethoxycarbonyl isothiocyanate Ethyl isothiocyanatoformate Ethyl N-(sulfanylidenemethylidene)carbamate Ethyl N-(thioxomethylene)carbamate N-(sulfanylidenemethylidene)carbamic acid ethyl ester N-(thioxomethylene)carbamic acid ethyl ester EINECS 240-318-9
Wiley ID 1133249