| SpectraBase Compound ID | 9bzP2zzOYS5 |
|---|---|
| InChI | InChI=1S/C9H10O2/c1-7-4-3-5-8(6-7)9(10)11-2/h3-6H,1-2H3 |
| InChIKey | CPXCDEMFNPKOEF-UHFFFAOYSA-N |
| Mol Weight | 150.18 g/mol |
| Molecular Formula | C9H10O2 |
| Exact Mass | 150.06808 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | BF9taw4Dj79 |
|---|---|
| Name | BENZOIC ACID, 3-METHYL-, METHYL ESTER |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C9H10O2 |
| InChI | InChI=1S/C9H10O2/c1-7-4-3-5-8(6-7)9(10)11-2/h3-6H,1-2H3 |
| InChIKey | CPXCDEMFNPKOEF-UHFFFAOYSA-N |
| Molecular Weight | 150.0678 |
| SMILES | c1(C(OC)=O)cccc(C)c1 |
| SPLASH | splash10-014l-9700000000-cf91969c5dc83f44b7db |
| Source of Spectrum | Chemical Concepts, A Wiley Division, Weinheim, Germany |