| SpectraBase Compound ID | 1sSK1HHwond |
|---|---|
| InChI | InChI=1S/C9H18O2/c1-5-7(2)6-8(3)9(10)11-4/h7-8H,5-6H2,1-4H3 |
| InChIKey | HPQMADMQZLWGED-UHFFFAOYSA-N |
| Mol Weight | 158.24 g/mol |
| Molecular Formula | C9H18O2 |
| Exact Mass | 158.13068 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 6k25BAgwcGq |
|---|---|
| Name | HEXANOIC ACID, 2,4-DIMETHYL-, METHYL ESTER |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C9H18O2 |
| InChI | InChI=1S/C9H18O2/c1-5-7(2)6-8(3)9(10)11-4/h7-8H,5-6H2,1-4H3 |
| InChIKey | HPQMADMQZLWGED-UHFFFAOYSA-N |
| Instrument Name | CH7 |
| Molecular Weight | 158.1302 |
| SMILES | CCC(CC(C(OC)=O)C)C |
| SPLASH | splash10-052r-9100000000-b561bc2c23df90cfa42e |
| Source of Spectrum | Chemical Concepts, A Wiley Division, Weinheim, Germany |