| SpectraBase Compound ID | I4B55rPsR8P |
|---|---|
| InChI | InChI=1S/C8H7BrO2/c1-11-8(10)6-2-4-7(9)5-3-6/h2-5H,1H3 |
| InChIKey | CZNGTXVOZOWWKM-UHFFFAOYSA-N |
| Mol Weight | 215.05 g/mol |
| Molecular Formula | C8H7BrO2 |
| Exact Mass | 213.962942 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | HkWNYcutujg |
|---|---|
| Name | p-BROMOBENZOIC ACID, METHYL ESTER |
| Source of Sample | Eastman Organic Chemicals, Rochester, New York |
| Copyright | Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C8H7BrO2 |
| InChI | InChI=1S/C8H7BrO2/c1-11-8(10)6-2-4-7(9)5-3-6/h2-5H,1H3 |
| InChIKey | CZNGTXVOZOWWKM-UHFFFAOYSA-N |
| Melting Point | 77-79C |
| Molecular Weight | 215.05 |
| Solvent | Chloroform-d; Reference=TMS Spectrometer= Varian CFT-20 |
| Synonyms | BENZOIC ACID, P-BROMO-, METHYL ESTER |