| SpectraBase Compound ID | 7CTII9G8PyK |
|---|---|
| InChI | InChI=1S/C13H18O2/c1-3-7-10(2)12(13(14)15)11-8-5-4-6-9-11/h4-6,8-10,12H,3,7H2,1-2H3,(H,14,15) |
| InChIKey | YUNSFLRLJVSMKM-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 | 20faZZAZ225 |
|---|---|
| Name | 3-Methyl-2-phenylhexanoic acid |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C13H18O2 |
| InChI | InChI=1S/C13H18O2/c1-3-7-10(2)12(13(14)15)11-8-5-4-6-9-11/h4-6,8-10,12H,3,7H2,1-2H3,(H,14,15) |
| InChIKey | YUNSFLRLJVSMKM-UHFFFAOYSA-N |
| Literature Reference DOI | 10.1002/adsc.201100372 |
| Molecular Weight | 206.285 g/mol |
| SMILES | OC(C(C(CCC)C)c1ccccc1)=O |
| SPLASH | splash10-000i-1900000000-3afa3dcc1d6201bc1ee4 |
| Source of Spectrum | ASC-353-3380/SM6-8_minor |
| Wiley ID | 1762494 |