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2-Thiophenecarboxamide, 3-cyanotetrahydro-2-[(phenylmethyl)thio]-, cis-
SpectraBase Compound ID 9CkJPXnPfdb
InChI InChI=1S/C13H14N2OS2/c14-8-11-6-7-17-13(11,12(15)16)18-9-10-4-2-1-3-5-10/h1-5,11H,6-7,9H2,(H2,15,16)
InChIKey MATMQHWJPBLTCB-UHFFFAOYSA-N
Mol Weight 278.39 g/mol
Molecular Formula C13H14N2OS2
Exact Mass 278.054755 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BIjVvORN2Q1
Name 2-Thiophenecarboxamide, 3-cyanotetrahydro-2-[(phenylmethyl)thio]-, cis-
CAS Registry Number 121498-23-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H14N2OS2
InChI InChI=1S/C13H14N2OS2/c14-8-11-6-7-17-13(11,12(15)16)18-9-10-4-2-1-3-5-10/h1-5,11H,6-7,9H2,(H2,15,16)
InChIKey MATMQHWJPBLTCB-UHFFFAOYSA-N
Molecular Weight 278.388 g/mol
SMILES NC(C1(C(C#N)CCS1)SCc1ccccc1)=O
SPLASH splash10-0a4o-8920000000-b9e9bd03dadb39451779
Source of Spectrum J-54-3666-8
Synonyms 2-(benzylsulfanyl)-3-cyanothiolane-2-carboxamide 2-(benzylthio)-2-carbamoyl-3-cyanotetrahydrothiophene
Wiley ID 1281642