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

*Links on SpectraBase are not permalinks.

(E,E)-2,6,10-Trimethyl-5-pivaloyloxy-12-(tetrahydropyran-2-yloxy)dodeca-6,10-dien-3-yne-2-ol

View entire compound with spectra: 1 NMR, and 1 MS (GC)

(E,E)-2,6,10-Trimethyl-5-pivaloyloxy-12-(tetrahydropyran-2-yloxy)dodeca-6,10-dien-3-yne-2-ol
SpectraBase Compound ID Dl2s4oWMKPo
InChI InChI=1S/C25H40O5/c1-19(15-18-29-22-13-8-9-17-28-22)11-10-12-20(2)21(14-16-25(6,7)27)30-23(26)24(3,4)5/h12,15,21-22,27H,8-11,13,17-18H2,1-7H3/b19-15+,20-12+
InChIKey OGRJSVFHHIAUOM-UYCURAHMSA-N
Mol Weight 420.6 g/mol
Molecular Formula C25H40O5
Exact Mass 420.287574 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 85KvhKypxyS
Name (E,E)-2,6,10-Trimethyl-5-pivaloyloxy-12-(tetrahydropyran-2-yloxy)dodeca-6,10-dien-3-yne-2-ol
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 420.287574383 u
Formula C25H40O5
InChI InChI=1S/C25H40O5/c1-19(15-18-29-22-13-8-9-17-28-22)11-10-12-20(2)21(14-16-25(6,7)27)30-23(26)24(3,4)5/h12,15,21-22,27H,8-11,13,17-18H2,1-7H3/b19-15+,20-12+
InChIKey OGRJSVFHHIAUOM-UYCURAHMSA-N
Molecular Weight 420.590 g/mol
SMILES C(#CC(O)(C)C)C(OC(C(C)(C)C)=O)\C(=C\CC\C(=C\COC1OCCCC1)C)C