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2-Methylthio-4-heptenenitrile
SpectraBase Compound ID 6EqifXIzteu
InChI InChI=1S/C8H13NS/c1-3-4-5-6-8(7-9)10-2/h4-5,8H,3,6H2,1-2H3
InChIKey UOPVZBLSLKYSQZ-UHFFFAOYSA-N
Mol Weight 155.26 g/mol
Molecular Formula C8H13NS
Exact Mass 155.076871 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Hi5lUspCWBs
Name 2-Methylthio-4-heptenenitrile
Alternate Name(s) 2-(methylthio)hept-4-enenitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H13NS
InChI InChI=1S/C8H13NS/c1-3-4-5-6-8(7-9)10-2/h4-5,8H,3,6H2,1-2H3
InChIKey UOPVZBLSLKYSQZ-UHFFFAOYSA-N
Literature Reference DOI 10.1002/jccs.200300149
Molecular Weight 155.259 g/mol
SMILES C(#N)C(CC=CCC)SC
SPLASH splash10-000i-9100000000-159a7eedc2f7dfdb6362
Source of Spectrum QA-50-1054-3a
Wiley ID 1795800