| SpectraBase Spectrum ID |
4laPIlz3Tff |
| Name |
Benzoic acid, 2-methyl-3-nitro- |
| Alternate Name(s) |
2-Methyl-3-nitro-benzoic acid
3-Nitro-2-methyl benzoic acid
3-Nitro-o-toluic acid
EINECS 217-826-4 |
| CAS Registry Number |
1975-50-4 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C8H7NO4 |
| InChI |
InChI=1S/C8H7NO4/c1-5-6(8(10)11)3-2-4-7(5)9(12)13/h2-4H,1H3,(H,10,11) |
| InChIKey |
YPQAFWHSMWWPLX-UHFFFAOYSA-N |
| Molecular Weight |
181.147 g/mol |
| SMILES |
OC(c1cccc(c1C)N(=O)=O)=O |
| SPLASH |
splash10-03g3-9200000000-9ba587f5abbc021ae784 |
| Source of Spectrum |
W6-13012-0-0 |
| Wiley ID |
88620 |
