| SpectraBase Compound ID | 4Raa7ewRp8R |
|---|---|
| InChI | InChI=1S/C13H18O2/c1-10(2)8-9-15-13(14)12-6-4-11(3)5-7-12/h4-7,10H,8-9H2,1-3H3 |
| InChIKey | WDNOGGRIGNCXKH-UHFFFAOYSA-N |
| Mol Weight | 206.28 g/mol |
| Molecular Formula | C13H18O2 |
| Exact Mass | 206.13068 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | JI8GKY3X1EM |
|---|---|
| Name | BENZOIC ACID, 4-METHYL, 3-METHYLBUTYL ESTER |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C13H18O2 |
| InChI | InChI=1S/C13H18O2/c1-10(2)8-9-15-13(14)12-6-4-11(3)5-7-12/h4-7,10H,8-9H2,1-3H3 |
| InChIKey | WDNOGGRIGNCXKH-UHFFFAOYSA-N |
| Molecular Weight | 206.1302 |
| SMILES | Cc1ccc(C(OCCC(C)C)=O)cc1 |
| SPLASH | splash10-014u-9600000000-b1957e5a3ae2e8d1f311 |
| Source of Spectrum | Chemical Concepts, A Wiley Division, Weinheim, Germany |