| SpectraBase Spectrum ID |
6RYd0fLF5iI |
| Name |
Benzene, 2-methyl-1-nitro-4-[(phenylmethyl)thio]- |
| Alternate Name(s) |
Sulfide, benzyl 4-nitro-m-tolyl
4-(benzylsulfanyl)-2-methyl-1-nitrobenzene
benzyl 3-methyl-4-nitrophenyl sulfide
p-Nitro-m-methylphenyl benzyl sulfide |
| CAS Registry Number |
93985-68-3 |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C14H13NO2S |
| InChI |
InChI=1S/C14H13NO2S/c1-11-9-13(7-8-14(11)15(16)17)18-10-12-5-3-2-4-6-12/h2-9H,10H2,1H3 |
| InChIKey |
IDKBJEURUBRKGX-UHFFFAOYSA-N |
| Molecular Weight |
259.323 g/mol |
| SMILES |
c1(N(=O)=O)c(cc(SCc2ccccc2)cc1)C |
| SPLASH |
splash10-0006-9010000000-d8770a03acda267dc89b |
| Source of Spectrum |
I-68-1454-0 |
| Wiley ID |
1262663 |
![Benzene, 2-methyl-1-nitro-4-[(phenylmethyl)thio]-](/api/spectrum/6RYd0fLF5iI/structure.png?h=300&w=458 "Benzene, 2-methyl-1-nitro-4-[(phenylmethyl)thio]-")
