| SpectraBase Compound ID | INdaMjnKmok |
|---|---|
| InChI | InChI=1S/C9H18O3/c1-3-4-5-6-8(10)7-9(11)12-2/h8,10H,3-7H2,1-2H3 |
| InChIKey | FHWBTAQRRDZDIY-UHFFFAOYSA-N |
| Mol Weight | 174.24 g/mol |
| Molecular Formula | C9H18O3 |
| Exact Mass | 174.125594 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 9XcahsKuaDr |
|---|---|
| Name | OCTANOIC ACID, 3-HYDROXY-, METHYL ESTER |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C9H18O3 |
| InChI | InChI=1S/C9H18O3/c1-3-4-5-6-8(10)7-9(11)12-2/h8,10H,3-7H2,1-2H3 |
| InChIKey | FHWBTAQRRDZDIY-UHFFFAOYSA-N |
| Molecular Weight | 174.1251 |
| SMILES | OC(CCCCC)CC(OC)=O |
| SPLASH | splash10-0fdo-9200000000-d0808695c11f06604320 |
| Source of Spectrum | Chemical Concepts, A Wiley Division, Weinheim, Germany |