| SpectraBase Compound ID | SWLI5GN0kr |
|---|---|
| InChI | InChI=1S/C9H8BrNO4/c10-8(5-9(12)13)6-2-1-3-7(4-6)11(14)15/h1-4,8H,5H2,(H,12,13) |
| InChIKey | DEKRYHWYJDKPOF-UHFFFAOYSA-N |
| Mol Weight | 274.07 g/mol |
| Molecular Formula | C9H8BrNO4 |
| Exact Mass | 272.963671 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 1JmPAW1SohY |
|---|---|
| Name | 3-BROMO-3-(3-NITRO-PHENYL)PROPIONIC ACID |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C9H8NO4Br |
| InChI | InChI=1S/C9H8BrNO4/c10-8(5-9(12)13)6-2-1-3-7(4-6)11(14)15/h1-4,8H,5H2,(H,12,13) |
| InChIKey | DEKRYHWYJDKPOF-UHFFFAOYSA-N |
| Molecular Weight | 272.9634 |
| SMILES | OC(=O)CC(Br)c1cccc(N(=O)=O)c1 |
| SPLASH | splash10-0ufr-9700000000-e454dffe6781a1efe17c |
| Source of Spectrum | Chemical Concepts, A Wiley Division, Weinheim, Germany |