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Ethyl isothiocyanatoacetate
SpectraBase Compound ID LNts5zGjqHl
InChI InChI=1S/C5H7NO2S/c1-2-8-5(7)3-6-4-9/h2-3H2,1H3
InChIKey IYPSSPPKMLXXRN-UHFFFAOYSA-N
Mol Weight 145.18 g/mol
Molecular Formula C5H7NO2S
Exact Mass 145.01975 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DXLzZsplL8
Name ACETIC ACID, ISOTHIOCYANATO-, ETHYL ESTER
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Exact Mass 145.019749641 u
Formula C5H7NO2S
InChI InChI=1S/C5H7NO2S/c1-2-8-5(7)3-6-4-9/h2-3H2,1H3
InChIKey IYPSSPPKMLXXRN-UHFFFAOYSA-N
Molecular Weight 145.176 g/mol
Nominal Mass 145 u
Number of Peaks 50
SMILES CCOC(CN=C=S)=O
SPLASH splash10-00dj-9200000000-4501d5882f849ef5d269
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany
Wiley ID MVX_001260