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N-benzyl-2-thiophenecarbothioamide

View entire compound with spectra: 1 MS (GC)

N-benzyl-2-thiophenecarbothioamide
SpectraBase Compound ID GluHToR7U9f
InChI InChI=1S/C12H11NS2/c14-12(11-7-4-8-15-11)13-9-10-5-2-1-3-6-10/h1-8H,9H2,(H,13,14)
InChIKey LBAICCQMMUNJKQ-UHFFFAOYSA-N
Mol Weight 233.35 g/mol
Molecular Formula C12H11NS2
Exact Mass 233.033292 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID E2D1LVhWFQ4
Name N-benzyl-2-thiophenecarbothioamide
Appearance Yellow solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 233.033291706 u
Formula C12H11NS2
InChI InChI=1S/C12H11NS2/c14-12(11-7-4-8-15-11)13-9-10-5-2-1-3-6-10/h1-8H,9H2,(H,13,14)
InChIKey LBAICCQMMUNJKQ-UHFFFAOYSA-N
Instrument Name Shimadzu QP 1000
Ionization Type EI
Literature Reference DOI 10.1002/chem.201504247
Molecular Weight 233.347 g/mol
Quality 123
Reported Formula C12H11NS2
SMILES N(CC1=CC=CC=C1)C(=S)C=1SC=CC1
SPLASH splash10-003u-4590000000-a30ec8ebd7e8616b4b84
Source of Spectrum QE-21-SM23-22 (DOI: 10.1002/chem.201504247)
Wiley ID 1907530