| SpectraBase Compound ID | 7bPhkdZ84yU |
|---|---|
| InChI | InChI=1S/C8H8O2/c1-10-8(9)7-5-3-2-4-6-7/h2-6H,1H3 |
| InChIKey | QPJVMBTYPHYUOC-UHFFFAOYSA-N |
| Mol Weight | 136.15 g/mol |
| Molecular Formula | C8H8O2 |
| Exact Mass | 136.052429 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 2u5KZlCT1MG |
|---|---|
| Name | Benzoic acid, methyl ester |
| CAS Registry Number | 93-58-3 |
| Comments | C-C-COUPLING FROM 2ND REFERENCE P.E.HANSEN,A.BERG,ORG.MAGN.RESO |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C8H8O2 |
| InChI | InChI=1S/C8H8O2/c1-10-8(9)7-5-3-2-4-6-7/h2-6H,1H3 |
| InChIKey | QPJVMBTYPHYUOC-UHFFFAOYSA-N |
| Instrument Name | Varian XL-100 |
| NMR Standard | TMS |
| Origin | Chemical Concepts. A Wiley Division. Weinheim, Germany |
| Solvent | CDCl3 |