SpectraBase Compound ID | 6zuUf2dMCAU |
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InChI | InChI=1S/C13H26O3/c1-3-5-7-8-9-10-12(14)13(15)16-11-6-4-2/h12,14H,3-11H2,1-2H3 |
InChIKey | NWNYPNCPNXEJBW-UHFFFAOYSA-N |
Mol Weight | 230.35 g/mol |
Molecular Formula | C13H26O3 |
Exact Mass | 230.188195 g/mol |
SpectraBase Spectrum ID | 5ah9aZMHFCa |
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Name | Nonanoic acid, 2-hydroxy-, butyl ester |
Comments | Computed using HOSE algorithm |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 230.188194694 u |
Formula | C13H26O3 |
InChI | InChI=1S/C13H26O3/c1-3-5-7-8-9-10-12(14)13(15)16-11-6-4-2/h12,14H,3-11H2,1-2H3 |
InChIKey | NWNYPNCPNXEJBW-UHFFFAOYSA-N |
Molecular Weight | 230.348 g/mol |
SMILES | OC(CCCCCCC)C(OCCCC)=O |