SpectraBase Compound ID | HI7ow3UsaEo |
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InChI | InChI=1S/C20H38O2/c1-3-5-7-9-10-11-12-13-14-15-17-19-22-20(21)18-16-8-6-4-2/h16,18H,3-15,17,19H2,1-2H3/b18-16+ |
InChIKey | XLOGXVLKOINOTI-FBMGVBCBSA-N |
Mol Weight | 310.5 g/mol |
Molecular Formula | C20H38O2 |
Exact Mass | 310.28718 g/mol |
SpectraBase Spectrum ID | 2ZgbD7tUoyj |
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Name | 2-Heptenoic acid, tridecyl ester |
Comments | Computed using HOSE algorithm |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 310.287180462 u |
Formula | C20H38O2 |
InChI | InChI=1S/C20H38O2/c1-3-5-7-9-10-11-12-13-14-15-17-19-22-20(21)18-16-8-6-4-2/h16,18H,3-15,17,19H2,1-2H3/b18-16+ |
InChIKey | XLOGXVLKOINOTI-FBMGVBCBSA-N |
Molecular Weight | 310.522 g/mol |
SMILES | C(\C=C\C(OCCCCCCCCCCCCC)=O)CCC |