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Benzenecarbothioamide, N-[(4-nitrophenyl)methyl]-
SpectraBase Compound ID BJaQJm5h7xU
InChI InChI=1S/C14H12N2O2S/c17-16(18)13-8-6-11(7-9-13)10-15-14(19)12-4-2-1-3-5-12/h1-9H,10H2,(H,15,19)
InChIKey QPVPTASPIDHDBZ-UHFFFAOYSA-N
Mol Weight 272.32 g/mol
Molecular Formula C14H12N2O2S
Exact Mass 272.061949 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6nuKlVJqix7
Name Benzenecarbothioamide, N-[(4-nitrophenyl)methyl]-
Alternate Name(s) 1-Nitro-4-(N-(phenyl(thioxo)methyl)aminomethyl)benzene N-(4-nitrobenzyl)benzenecarbothioamide
CAS Registry Number 65159-48-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H12N2O2S
InChI InChI=1S/C14H12N2O2S/c17-16(18)13-8-6-11(7-9-13)10-15-14(19)12-4-2-1-3-5-12/h1-9H,10H2,(H,15,19)
InChIKey QPVPTASPIDHDBZ-UHFFFAOYSA-N
Molecular Weight 272.322 g/mol
SMILES N(C(=S)c1ccccc1)Cc1ccc(N(=O)=O)cc1
SPLASH splash10-00di-1590000000-17299c7e9e699c064fec
Source of Spectrum F-44-7279-23
Wiley ID 1275952