| SpectraBase Compound ID | KGHFav2yV45 |
|---|---|
| InChI | InChI=1S/C9H18O2/c1-4-6-8(5-2)7-9(10)11-3/h8H,4-7H2,1-3H3 |
| InChIKey | XWOBLXFYSMSMRW-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 | 3xk9boNcLDJ |
|---|---|
| Name | HEXANOIC ACID, 3-ETHYL-, METHYL ESTER |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C9H18O2 |
| InChI | InChI=1S/C9H18O2/c1-4-6-8(5-2)7-9(10)11-3/h8H,4-7H2,1-3H3 |
| InChIKey | XWOBLXFYSMSMRW-UHFFFAOYSA-N |
| Instrument Name | CH7 |
| Molecular Weight | 158.1302 |
| SMILES | CCCC(CC(OC)=O)CC |
| SPLASH | splash10-006x-9000000000-4c334997021550f25995 |
| Source of Spectrum | Chemical Concepts, A Wiley Division, Weinheim, Germany |