| SpectraBase Compound ID | BPSEpzi01FM |
|---|---|
| InChI | InChI=1S/C8H7N3O2/c1-5-4-6(10-11-9)2-3-7(5)8(12)13/h2-4H,1H3,(H,12,13) |
| InChIKey | IFAOMEPQYOVFOT-UHFFFAOYSA-N |
| Mol Weight | 177.16 g/mol |
| Molecular Formula | C8H7N3O2 |
| Exact Mass | 177.053826 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 10k7sjciXIc |
|---|---|
| Name | 4-Azido-2-methylbenzoic Acid |
| Comments | Less than 3 mono-isotopic peaks |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C8H7N3O2 |
| InChI | InChI=1S/C8H7N3O2/c1-5-4-6(10-11-9)2-3-7(5)8(12)13/h2-4H,1H3,(H,12,13) |
| InChIKey | IFAOMEPQYOVFOT-UHFFFAOYSA-N |
| Molecular Weight | 177.163 g/mol |
| SMILES | OC(c1c(cc(cc1)N=[N+]=[N-])C)=O |
| SPLASH | splash10-002b-0900000000-123b05af4918e74b56af |
| Source of Spectrum | HE-2005-2212-0 |
| Wiley ID | 1613819 |