| SpectraBase Compound ID | HoIzVGaCzSo |
|---|---|
| InChI | InChI=1S/C10H12O3/c1-7(2)13-10(12)8-4-3-5-9(11)6-8/h3-7,11H,1-2H3 |
| InChIKey | VANDBVAFPVUVNX-UHFFFAOYSA-N |
| Mol Weight | 180.2 g/mol |
| Molecular Formula | C10H12O3 |
| Exact Mass | 180.078644 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | yplRSd0i2A |
|---|---|
| Name | BENZOIC ACID, 3-HYDROXY-, 1-METHYLETHYL ESTER |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C10H12O3 |
| InChI | InChI=1S/C10H12O3/c1-7(2)13-10(12)8-4-3-5-9(11)6-8/h3-7,11H,1-2H3 |
| InChIKey | VANDBVAFPVUVNX-UHFFFAOYSA-N |
| Molecular Weight | 180.0783 |
| SMILES | Oc1cc(C(OC(C)C)=O)ccc1 |
| SPLASH | splash10-00dr-4900000000-023a4dc2724fb5a46a71 |
| Source of Spectrum | Chemical Concepts, A Wiley Division, Weinheim, Germany |