| SpectraBase Compound ID | 5sclLNcaEUA |
|---|---|
| InChI | InChI=1S/C8H6N2O2/c1-6-3-2-4-8(10(11)12)7(6)5-9/h2-4H,1H3 |
| InChIKey | BOTPDHNZLRJZOO-UHFFFAOYSA-N |
| Mol Weight | 162.15 g/mol |
| Molecular Formula | C8H6N2O2 |
| Exact Mass | 162.042927 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | LuEaQEFTElL |
|---|---|
| Name | BENZOIC ACID NITRILE, 2-NITRO-6-METHYL- |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C8H6N2O2 |
| InChI | InChI=1S/C8H6N2O2/c1-6-3-2-4-8(10(11)12)7(6)5-9/h2-4H,1H3 |
| InChIKey | BOTPDHNZLRJZOO-UHFFFAOYSA-N |
| Instrument Name | 311A |
| Molecular Weight | 162.0428 |
| SMILES | c1ccc(N(=O)=O)c(C#N)c1C |
| SPLASH | splash10-000i-9400000000-99fe3b4eb818f7e47367 |
| Source of Spectrum | Chemical Concepts, A Wiley Division, Weinheim, Germany |