| SpectraBase Compound ID | Is0v2TNiaOj |
|---|---|
| InChI | InChI=1S/C7H7NO2/c1-6-2-4-7(5-3-6)8(9)10/h2-5H,1H3 |
| InChIKey | ZPTVNYMJQHSSEA-UHFFFAOYSA-N |
| Mol Weight | 137.14 g/mol |
| Molecular Formula | C7H7NO2 |
| Exact Mass | 137.047678 g/mol |
17O Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 3rxpTMt4Bna |
|---|---|
| Name | 4-NITROTOLUENE |
| CAS Registry Number | 99-99-0 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C7H7NO2 |
| InChI | InChI=1S/C7H7NO2/c1-6-2-4-7(5-3-6)8(9)10/h2-5H,1H3 |
| InChIKey | ZPTVNYMJQHSSEA-UHFFFAOYSA-N |
| Literature Reference Author | A.J.RAGAUSKAS,J.B.STOTHERS |
| Literature Reference Citation | J.AM.CHEM.SOC.,104,6475(1982) |
| Literature Reference DOI | 10.1021/ja00387a066 |
| Solvent | CH3CN |
| Source File Reference | UHPK2927 |