| SpectraBase Compound ID | 1CTRN3WvOtQ |
|---|---|
| InChI | InChI=1S/C14H28O2/c1-3-5-7-9-11-13(14(15)16)12-10-8-6-4-2/h13H,3-12H2,1-2H3,(H,15,16) |
| InChIKey | SQPZLZZLAPHSPL-UHFFFAOYSA-N |
| Mol Weight | 228.38 g/mol |
| Molecular Formula | C14H28O2 |
| Exact Mass | 228.20893 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | AqcPHfUTPTP |
|---|---|
| Name | OCTANOIC ACID, 2-HEXYL- |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C14H28O2 |
| InChI | InChI=1S/C14H28O2/c1-3-5-7-9-11-13(14(15)16)12-10-8-6-4-2/h13H,3-12H2,1-2H3,(H,15,16) |
| InChIKey | SQPZLZZLAPHSPL-UHFFFAOYSA-N |
| Molecular Weight | 228.2082 |
| SMILES | OC(=O)C(CCCCCC)CCCCCC |
| SPLASH | splash10-0006-9800000000-c4c4fb7051b304aa809a |
| Source of Spectrum | Chemical Concepts, A Wiley Division, Weinheim, Germany |