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N-(4-cyano-2-cyclohexenyl)-o-ethyl-thiocarbamate
SpectraBase Compound ID CifxgQbOf6q
InChI InChI=1S/C10H14N2OS/c1-2-13-10(14)12-9-5-3-8(7-11)4-6-9/h3,5,8-9H,2,4,6H2,1H3,(H,12,14)
InChIKey SAQMLZLTYAFBEJ-UHFFFAOYSA-N
Mol Weight 210.29 g/mol
Molecular Formula C10H14N2OS
Exact Mass 210.082684 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2U1VIxWic3T
Name N-(4-cyano-2-cyclohexenyl)-o-ethyl-thiocarbamate
CAS Registry Number 112127-32-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H14N2OS
InChI InChI=1S/C10H14N2OS/c1-2-13-10(14)12-9-5-3-8(7-11)4-6-9/h3,5,8-9H,2,4,6H2,1H3,(H,12,14)
InChIKey SAQMLZLTYAFBEJ-UHFFFAOYSA-N
Molecular Weight 210.295 g/mol
SMILES N(C(=S)OCC)C1C=CC(C#N)CC1
SPLASH splash10-0hji-9320000000-c323b4ccd1420a22183a
Source of Spectrum H-69-1913-19
Synonyms O-ethyl 4-cyano-2-cyclohexen-1-ylthiocarbamate
Wiley ID 1208749