SpectraBase Compound ID | 1pD0SZ1OHLK |
---|---|
InChI | InChI=1S/C23H40O4/c1-18(24)27-15-11-9-7-5-6-8-10-12-21(25)17-19-16-20(23(2,3)4)13-14-22(19)26/h19-20H,5-17H2,1-4H3 |
InChIKey | XJEYQOMLDXDQRC-UHFFFAOYSA-N |
Mol Weight | 380.6 g/mol |
Molecular Formula | C23H40O4 |
Exact Mass | 380.29266 g/mol |
SpectraBase Spectrum ID | GnJdtntEunZ |
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Name | 10-Acetoxy-1-(5-tert-butyl-2-oxocyclohexylmethyl)decanal |
Comments | Computed using HOSE algorithm |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 380.292659764 u |
Formula | C23H40O4 |
InChI | InChI=1S/C23H40O4/c1-18(24)27-15-11-9-7-5-6-8-10-12-21(25)17-19-16-20(23(2,3)4)13-14-22(19)26/h19-20H,5-17H2,1-4H3 |
InChIKey | XJEYQOMLDXDQRC-UHFFFAOYSA-N |
Molecular Weight | 380.569 g/mol |
SMILES | C1(C(CCC(C1)C(C)(C)C)=O)CC(=O)CCCCCCCCCOC(=O)C |