| SpectraBase Compound ID | 5TJN5UkFgNr |
|---|---|
| InChI | InChI=1S/C8H7NO3/c1-3-7-9-6(5-12-7)8(10)11-4-2/h1,5H,4H2,2H3 |
| InChIKey | HOBJTKPWDGVNHQ-UHFFFAOYSA-N |
| Mol Weight | 165.15 g/mol |
| Molecular Formula | C8H7NO3 |
| Exact Mass | 165.042593 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 5kzEXclWIxf |
|---|---|
| Name | HOBJTKPWDGVNHQ-UHFFFAOYSA-N |
| Copyright | Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C8H7NO3 |
| InChI | InChI=1S/C8H7NO3/c1-3-7-9-6(5-12-7)8(10)11-4-2/h1,5H,4H2,2H3 |
| InChIKey | HOBJTKPWDGVNHQ-UHFFFAOYSA-N |
| Literature Reference Author | ORGANIC_CHEMISTRY_(NMR-DEPARTMENT);UNIVERSITY_MAINZ |
| Literature Reference Citation | UNI_MAINZ,INTERNAL_DB(2010) |
| Molecular Weight | 165.148 g/mol |
| Source File Reference | MHKO25610 |