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2,3-Dihydro-2-cyano-2-(tert-butylthio)benzo[b]thiophene
SpectraBase Compound ID 3QyZYaOYX6P
InChI InChI=1S/C13H15NS2/c1-12(2,3)16-13(9-14)8-10-6-4-5-7-11(10)15-13/h4-7H,8H2,1-3H3
InChIKey YPHUSBVBNLGMCT-UHFFFAOYSA-N
Mol Weight 249.39 g/mol
Molecular Formula C13H15NS2
Exact Mass 249.064592 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HIZFV34u26T
Name 2,3-Dihydro-2-cyano-2-(tert-butylthio)benzo[b]thiophene
Alternate Name(s) 2-(tert-butylsulfanyl)-2,3-dihydro-1-benzothiophene-2-carbonitrile
CAS Registry Number 92013-97-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H15NS2
InChI InChI=1S/C13H15NS2/c1-12(2,3)16-13(9-14)8-10-6-4-5-7-11(10)15-13/h4-7H,8H2,1-3H3
InChIKey YPHUSBVBNLGMCT-UHFFFAOYSA-N
Molecular Weight 249.390 g/mol
SMILES C1(Sc2ccccc2C1)(C#N)SC(C)(C)C
SPLASH splash10-08fr-4920000000-c8fa2d6db01917ec3a6a
Source of Spectrum J-49-4485-0
Wiley ID 1252147