| SpectraBase Compound ID | LgPFqOrqEoH |
|---|---|
| InChI | InChI=1S/C10H12O2/c1-8-5-3-4-6-9(8)7-10(11)12-2/h3-6H,7H2,1-2H3 |
| InChIKey | BLEMRRXGTKTJGT-UHFFFAOYSA-N |
| Mol Weight | 164.2 g/mol |
| Molecular Formula | C10H12O2 |
| Exact Mass | 164.08373 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 4ZAgKvIg7jf |
|---|---|
| Name | Benzeneacetic acid, 2-methyl-, methyl ester |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C10H12O2 |
| InChI | InChI=1S/C10H12O2/c1-8-5-3-4-6-9(8)7-10(11)12-2/h3-6H,7H2,1-2H3 |
| InChIKey | BLEMRRXGTKTJGT-UHFFFAOYSA-N |
| Molecular Weight | 164.0834 |
| SMILES | c1cc(C)c(CC(OC)=O)cc1 |
| SPLASH | splash10-016r-9100000000-65aee78f461b43a05b1a |
| Source of Spectrum | Chemical Concepts, A Wiley Division, Weinheim, Germany |