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2-Cyclopentene-1-propanenitrile, .alpha.-[(1,1-dimethylethyl)thio]-
SpectraBase Compound ID 99BDaWaAO5U
InChI InChI=1S/C12H19NS/c1-12(2,3)14-11(9-13)8-10-6-4-5-7-10/h4,6,10-11H,5,7-8H2,1-3H3
InChIKey WNGXFUHRCZNIFC-UHFFFAOYSA-N
Mol Weight 209.35 g/mol
Molecular Formula C12H19NS
Exact Mass 209.123821 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KoR2QisLDxe
Name 2-Cyclopentene-1-propanenitrile, .alpha.-[(1,1-dimethylethyl)thio]-
CAS Registry Number 108604-75-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H19NS
InChI InChI=1S/C12H19NS/c1-12(2,3)14-11(9-13)8-10-6-4-5-7-10/h4,6,10-11H,5,7-8H2,1-3H3
InChIKey WNGXFUHRCZNIFC-UHFFFAOYSA-N
Molecular Weight 209.351 g/mol
SMILES C(#N)C(SC(C)(C)C)CC1C=CCC1
SPLASH splash10-0a4l-9100000000-cfd81f2f42b753c94f16
Source of Spectrum F-42-1297-19
Synonyms 2-(tert-butylsulfanyl)-3-(2-cyclopenten-1-yl)propanenitrile 3-(2'-Cyclopen-tenyl)-1-tert-butylthiopropionitrile
Wiley ID 1208230