| SpectraBase Spectrum ID |
4OglFEq9qa |
| Name |
Benzoic acid, 2-(carboxymethylthio)-4-nitro-dimethyl ester |
| Alternate Name(s) |
Methyl 2-[(2-methoxy-2-oxoethyl)sulfanyl]-4-nitrobenzoate |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C11H11NO6S |
| InChI |
InChI=1S/C11H11NO6S/c1-17-10(13)6-19-9-5-7(12(15)16)3-4-8(9)11(14)18-2/h3-5H,6H2,1-2H3 |
| InChIKey |
DZCVDTCKHCFXEL-UHFFFAOYSA-N |
| Molecular Weight |
285.270 g/mol |
| SMILES |
c1(N(=O)=O)cc(SCC(=O)OC)c(cc1)C(=O)OC |
| SPLASH |
splash10-0f92-6490000000-fd6985256d8201904159 |
| Source of Spectrum |
RB-1982-10200-0 |
| Wiley ID |
1288701 |
