| SpectraBase Spectrum ID |
47MPUqaPJmn |
| Name |
Benzoic acid, 4-(cyclopentylthio)-3-nitro-, methyl ester |
| Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C13H15NO4S |
| InChI |
InChI=1S/C13H15NO4S/c1-18-13(15)9-6-7-12(11(8-9)14(16)17)19-10-4-2-3-5-10/h6-8,10H,2-5H2,1H3 |
| InChIKey |
AFIRPIUXGBESKU-UHFFFAOYSA-N |
| Molecular Weight |
281.326 g/mol |
| SMILES |
c1(cc(c(SC2CCCC2)cc1)N(=O)=O)C(OC)=O |
| SPLASH |
splash10-014l-9620000000-08b0273309808567e7da |
| Source of Spectrum |
IY-2-4748-6 |
| Synonyms |
Methyl 4-(cyclopentylsulfanyl)-3-nitrobenzoate
4-(cyclopentylthio)-3-nitrobenzoic acid methyl ester
Methyl 4-cyclopentylsulfanyl-3-nitrobenzoate
Methyl 4-cyclopentylsulfanyl-3-nitro-benzoate |
| Wiley ID |
1655469 |
