| SpectraBase Compound ID | CRclCO5NgfL |
|---|---|
| InChI | InChI=1S/C7H7NO3/c1-5-3-2-4-6(9)7(5)8(10)11/h2-4,9H,1H3 |
| InChIKey | QIORDSKCCHRSSD-UHFFFAOYSA-N |
| Mol Weight | 153.14 g/mol |
| Molecular Formula | C7H7NO3 |
| Exact Mass | 153.042593 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | BElrqZzmck8 |
|---|---|
| Name | PHENOL, 3-METHYL-2-NITRO- |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C7H7NO3 |
| InChI | InChI=1S/C7H7NO3/c1-5-3-2-4-6(9)7(5)8(10)11/h2-4,9H,1H3 |
| InChIKey | QIORDSKCCHRSSD-UHFFFAOYSA-N |
| Molecular Weight | 153.0424 |
| SMILES | Oc1c(N(=O)=O)c(C)ccc1 |
| SPLASH | splash10-0ug0-9300000000-614c2bcf47fffb4aadda |
| Source of Spectrum | Chemical Concepts, A Wiley Division, Weinheim, Germany |