For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
10-Acetoxy-1-(5-tert-butyl-2-oxocyclohexylmethyl)decanal
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

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID GnJdtntEunZ
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