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2-methyl-N-(p-tolyl)furan-3-carbothioamide
SpectraBase Compound ID 78JPd6XaARE
InChI InChI=1S/C13H13NOS/c1-9-3-5-11(6-4-9)14-13(16)12-7-8-15-10(12)2/h3-8H,1-2H3,(H,14,16)
InChIKey HVDMQORTDNBMAV-UHFFFAOYSA-N
Mol Weight 231.31 g/mol
Molecular Formula C13H13NOS
Exact Mass 231.071785 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HxlWT0PGJ9e
Name 2-methyl-N-(p-tolyl)furan-3-carbothioamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H13NOS
InChI InChI=1S/C13H13NOS/c1-9-3-5-11(6-4-9)14-13(16)12-7-8-15-10(12)2/h3-8H,1-2H3,(H,14,16)
InChIKey HVDMQORTDNBMAV-UHFFFAOYSA-N
Instrument Name Shimadzu QP-5000
Ionization Type EI
Literature Reference DOI 10.1002/rcm.1290090912
Molecular Weight 231.313 g/mol
SMILES N(C(c1c(occ1)C)=S)c1ccc(cc1)C
SPLASH splash10-004i-0900000000-c2842c2fb9c5320bc86d
Source of Spectrum RCM-9-779-7
Wiley ID 1835892