| SpectraBase Compound ID | HV408Xa1XqB |
|---|---|
| InChI | InChI=1S/C12H16O2/c1-9(2)8-14-12(13)11-6-4-10(3)5-7-11/h4-7,9H,8H2,1-3H3 |
| InChIKey | IELVQABKIBOBRG-UHFFFAOYSA-N |
| Mol Weight | 192.26 g/mol |
| Molecular Formula | C12H16O2 |
| Exact Mass | 192.11503 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | Irz5Lr7DWzy |
|---|---|
| Name | BENZOIC ACID, 4-METHYL-, 2-METHYLPROPYL ESTER |
| Copyright | Copyright © 2002-2025 Wiley-VCH GmbH. All Rights Reserved. |
| Formula | C12H16O2 |
| InChI | InChI=1S/C12H16O2/c1-9(2)8-14-12(13)11-6-4-10(3)5-7-11/h4-7,9H,8H2,1-3H3 |
| InChIKey | IELVQABKIBOBRG-UHFFFAOYSA-N |
| Molecular Weight | 192.1146 |
| SMILES | Cc1ccc(C(OCC(C)C)=O)cc1 |
| SPLASH | splash10-014r-6900000000-9373ff0c8275b6275ba8 |
| Source of Spectrum | Chemical Concepts, A Wiley Division, Weinheim, Germany |