| SpectraBase Spectrum ID |
FfDi2TreyUt |
| Name |
Benzene, 1-[2,2-dimethyl-1-[(4-methylphenyl)thio]propyl]-3-nitro- |
| CAS Registry Number |
86096-99-3 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C18H21NO2S |
| InChI |
InChI=1S/C18H21NO2S/c1-13-8-10-16(11-9-13)22-17(18(2,3)4)14-6-5-7-15(12-14)19(20)21/h5-12,17H,1-4H3 |
| InChIKey |
BGISYQSXJJYMBR-UHFFFAOYSA-N |
| Molecular Weight |
315.431 g/mol |
| SMILES |
c1(N(=O)=O)cc(C(Sc2ccc(cc2)C)C(C)(C)C)ccc1 |
| SPLASH |
splash10-0a4i-4792000000-efb216bbad2275b45402 |
| Source of Spectrum |
B-36-93-0 |
| Synonyms |
1-{2,2-dimethyl-1-[(4-methylphenyl)sulfanyl]propyl}-3-nitrobenzene
2,2-Dimethyl-1-(3-nitrophenyl)propyl 4-methylphenyl sulfide
2,2-Dimethyl-1-(m-nitrophenyl)propyl p-tolyl sulfide |
| Wiley ID |
1315989 |
![Benzene, 1-[2,2-dimethyl-1-[(4-methylphenyl)thio]propyl]-3-nitro-](/api/spectrum/FfDi2TreyUt/structure.png?h=300&w=458 "Benzene, 1-[2,2-dimethyl-1-[(4-methylphenyl)thio]propyl]-3-nitro-")
