exo-2-cyano-endo-2-thiomethyl-bicyclo[2.2.2]oct-5-ene

SpectraBase Compound ID	1fFyQtKJ1hB
InChI	InChI=1S/C10H13NS/c1-12-10(7-11)6-8-2-4-9(10)5-3-8/h2,4,8-9H,3,5-6H2,1H3
InChIKey	JHUMSYMRDNPHRN-UHFFFAOYSA-N Google Search
Mol Weight	179.28 g/mol
Molecular Formula	C10H13NS
Exact Mass	179.076871 g/mol

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SpectraBase Spectrum ID	9rmOCjViufd
Name	exo-2-cyano-endo-2-thiomethyl-bicyclo[2.2.2]oct-5-ene
CAS Registry Number	82297-21-0
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C10H13NS
InChI	InChI=1S/C10H13NS/c1-12-10(7-11)6-8-2-4-9(10)5-3-8/h2,4,8-9H,3,5-6H2,1H3
InChIKey	JHUMSYMRDNPHRN-UHFFFAOYSA-N
Molecular Weight	179.281 g/mol
SMILES	C1(C#N)(C2C=CC(C1)CC2)SC
SPLASH	splash10-0059-9200000000-2fa3b87610eec108a4db
Source of Spectrum	F-42-3879-8
Synonyms	exo-2-cyano-exo-2-thiomethyl-bicyclo[2.2.2]oct-5-ene 2-(methylsulfanyl)bicyclo[2.2.2]oct-5-ene-2-carbonitrile exo-2-cyano-endo-2-methylthiobicyclo[2.2.2]oct-5-ene
Wiley ID	1175335