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Benzene, 1-methyl-4-[(2-nitro-1,2-diphenylethenyl)thio]-, (E)-
SpectraBase Compound ID FjLIcqnGPOR
InChI InChI=1S/C21H17NO2S/c1-16-12-14-19(15-13-16)25-21(18-10-6-3-7-11-18)20(22(23)24)17-8-4-2-5-9-17/h2-15H,1H3/b21-20+
InChIKey VZUCEBIMABVVGX-QZQOTICOSA-N
Mol Weight 347.43 g/mol
Molecular Formula C21H17NO2S
Exact Mass 347.098 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID A6f58AVd6XN
Name Benzene, 1-methyl-4-[(2-nitro-1,2-diphenylethenyl)thio]-, (E)-
Alternate Name(s) 1-Methyl-4-{[(E)-2-nitro-1,2-diphenylethenyl]sulfanyl}benzene 4-Methylphenyl (E)-2-nitro-1,2-diphenylethenyl sulfide
CAS Registry Number 73013-89-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H17NO2S
InChI InChI=1S/C21H17NO2S/c1-16-12-14-19(15-13-16)25-21(18-10-6-3-7-11-18)20(22(23)24)17-8-4-2-5-9-17/h2-15H,1H3/b21-20+
InChIKey VZUCEBIMABVVGX-QZQOTICOSA-N
Molecular Weight 347.432 g/mol
SMILES c1(S\C(=C/(N(=O)=O)c2ccccc2)c2ccccc2)ccc(cc1)C
SPLASH splash10-0550-1900000000-0e1abf0cfc1b39812ffe
Source of Spectrum J-54-5977-0
Wiley ID 1340078