For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
Benzene, 2-methyl-4-[(4-methylphenyl)thio]-1-nitro-
SpectraBase Compound ID J85NvrUNsrt
InChI InChI=1S/C14H13NO2S/c1-10-3-5-12(6-4-10)18-13-7-8-14(15(16)17)11(2)9-13/h3-9H,1-2H3
InChIKey ZQVSOGUCGYGNAW-UHFFFAOYSA-N
Mol Weight 259.32 g/mol
Molecular Formula C14H13NO2S
Exact Mass 259.0667 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID HKZjpEf2Q8m
Name Benzene, 2-methyl-4-[(4-methylphenyl)thio]-1-nitro-
CAS Registry Number 53258-92-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H13NO2S
InChI InChI=1S/C14H13NO2S/c1-10-3-5-12(6-4-10)18-13-7-8-14(15(16)17)11(2)9-13/h3-9H,1-2H3
InChIKey ZQVSOGUCGYGNAW-UHFFFAOYSA-N
Molecular Weight 259.323 g/mol
SMILES c1(N(=O)=O)c(cc(Sc2ccc(cc2)C)cc1)C
SPLASH splash10-0a4i-0390000000-942b11b3e5354a631a5a
Source of Spectrum I-68-1454-6
Synonyms 2-Methyl-4-[(4-methylphenyl)sulfanyl]-1-nitrobenzene 3-Methyl-4-nitrophenyl 4-methylphenyl sulfide p-Nitro-m-methylphenyl p-tolyl sulfide
Wiley ID 1262664