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4-(2'-Cyanoethylthio)-5-pentylthio-1,3-dithiol-2-one
SpectraBase Compound ID 97lnbtQIMC4
InChI InChI=1S/C11H15NOS4/c1-2-3-4-7-14-9-10(15-8-5-6-12)17-11(13)16-9/h2-5,7-8H2,1H3
InChIKey GQFAFCLNKPEJQJ-UHFFFAOYSA-N
Mol Weight 305.5 g/mol
Molecular Formula C11H15NOS4
Exact Mass 305.003649 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ASXXoRj1jLO
Name 4-(2'-Cyanoethylthio)-5-pentylthio-1,3-dithiol-2-one
Alternate Name(s) 3-{[2-oxo-5-(pentylsulfanyl)-1,3-dithiol-4-yl]sulfanyl}propanenitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H15NOS4
InChI InChI=1S/C11H15NOS4/c1-2-3-4-7-14-9-10(15-8-5-6-12)17-11(13)16-9/h2-5,7-8H2,1H3
InChIKey GQFAFCLNKPEJQJ-UHFFFAOYSA-N
Molecular Weight 305.487 g/mol
SMILES C1(SC(=C(S1)SCCC#N)SCCCCC)=O
SPLASH splash10-0ab9-6419000000-66bd31dbf12e5e54a4c1
Source of Spectrum QF-8-4466-3
Wiley ID 1558052