SpectraBase Compound ID | 9LGXRHwNDIL |
---|---|
InChI | InChI=1S/C17H34O2/c1-5-6-7-8-9-10-11-12-13-14-17(18)19-16(4)15(2)3/h15-16H,5-14H2,1-4H3 |
InChIKey | BPATUEDDMFPLJI-UHFFFAOYSA-N |
Mol Weight | 270.5 g/mol |
Molecular Formula | C17H34O2 |
Exact Mass | 270.25588 g/mol |
SpectraBase Spectrum ID | FBMj3qXYSQZ |
---|---|
Name | Dodecanoic acid, 3-methylbut-2-yl ester |
Comments | Computed using HOSE algorithm |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 270.255880333 u |
Formula | C17H34O2 |
InChI | InChI=1S/C17H34O2/c1-5-6-7-8-9-10-11-12-13-14-17(18)19-16(4)15(2)3/h15-16H,5-14H2,1-4H3 |
InChIKey | BPATUEDDMFPLJI-UHFFFAOYSA-N |
Molecular Weight | 270.457 g/mol |
SMILES | CCCCCCCCCCCC(=O)OC(C(C)C)C |