| SpectraBase Compound ID | L2eYjlx4tNW |
|---|---|
| InChI | InChI=1S/C8H7NO4/c1-5-4-6(8(10)11)2-3-7(5)9(12)13/h2-4H,1H3,(H,10,11) |
| InChIKey | XDTTUTIFWDAMIX-UHFFFAOYSA-N |
| Mol Weight | 181.15 g/mol |
| Molecular Formula | C8H7NO4 |
| Exact Mass | 181.037508 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | DTWydKs8hwW |
|---|---|
| Name | 4-NITRO-m-TOLUIC ACID |
| Source of Sample | Calbiochem, Los Angeles, California |
| Copyright | Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C8H7NO4 |
| InChI | InChI=1S/C8H7NO4/c1-5-4-6(8(10)11)2-3-7(5)9(12)13/h2-4H,1H3,(H,10,11) |
| InChIKey | XDTTUTIFWDAMIX-UHFFFAOYSA-N |
| Melting Point | 216-218C |
| Molecular Weight | 181.15 |
| Solvent | Polysol; Reference=TMS Spectrometer= Varian CFT-20 |
| Synonyms | M-TOLUIC ACID, 4-NITRO-, BENZOIC ACID, 3-METHYL-4-NITRO-, |