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

*Links on SpectraBase are not permalinks.

Phenyl 3-hydroxy-4-methyl-4-[2,2,5-trimethyl-6-(pent-4-en-1-yl)-1,3-dioxan-4-yl]-pentanoate

View entire compound with spectra: 1 MS (GC)

Phenyl 3-hydroxy-4-methyl-4-[2,2,5-trimethyl-6-(pent-4-en-1-yl)-1,3-dioxan-4-yl]-pentanoate
SpectraBase Compound ID HCCUci8IzcH
InChI InChI=1S/C24H36O5/c1-8-12-16(2)21-17(3)22(29-24(6,7)28-21)23(4,5)19(25)15-20(26)27-18-13-10-9-11-14-18/h8-11,13-14,16-17,19,21-22,25H,1,12,15H2,2-7H3/t16-,17+,19+,21-,22+/m1/s1
InChIKey SQBQYRDMNWWFBL-PJRIKHGVSA-N
Mol Weight 404.5 g/mol
Molecular Formula C24H36O5
Exact Mass 404.256274 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

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

SpectraBase Spectrum ID LeOUwh0SqP3
Name Phenyl 3-hydroxy-4-methyl-4-[2,2,5-trimethyl-6-(pent-4-en-1-yl)-1,3-dioxan-4-yl]-pentanoate
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H36O5
InChI InChI=1S/C24H36O5/c1-8-12-16(2)21-17(3)22(29-24(6,7)28-21)23(4,5)19(25)15-20(26)27-18-13-10-9-11-14-18/h8-11,13-14,16-17,19,21-22,25H,1,12,15H2,2-7H3/t16-,17+,19+,21-,22+/m1/s1
InChIKey SQBQYRDMNWWFBL-PJRIKHGVSA-N
Molecular Weight 404.547 g/mol
SMILES O[C@@](CC(Oc1ccccc1)=O)(C([C@@]1([C@]([C@](OC(O1)(C)C)([C@@](CC=C)(C)[H])[H])(C)[H])[H])(C)C)[H]
SPLASH splash10-000i-0009100000-334cf9fba1d310e37d42
Source of Spectrum C-122-10530-46
Wiley ID 1700424