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

*Links on SpectraBase are not permalinks.
(1R,2R,3S,4S)-2-{(1E)-1-Methylpropen-1-yl)-3,4-di(4-methoxybenzyloxy)cyclohexan-1-ol
SpectraBase Compound ID 2fyxCwYEZkX
InChI InChI=1S/C26H34O5/c1-5-18(2)25-23(27)14-15-24(30-16-19-6-10-21(28-3)11-7-19)26(25)31-17-20-8-12-22(29-4)13-9-20/h5-13,23-27H,14-17H2,1-4H3/b18-5+/t23-,24+,25-,26-/m1/s1
InChIKey FJJQCYKJNPZSDN-ZMXYDZBPSA-N
Mol Weight 426.6 g/mol
Molecular Formula C26H34O5
Exact Mass 426.240624 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 C2ZWkoywg0
Name (1R,2R,3S,4S)-2-{(1E)-1-Methylpropen-1-yl)-3,4-di(4-methoxybenzyloxy)cyclohexan-1-ol
Alternate Name(s) (1R,2R,3S,4S)-2-{(1E)-1-Methylpropen-1-yl)-3,4-di(4-methoxybenzyl)cyclohexan-1-ol (1R,2R,3S,4S)-3,4-bis[(4-methoxybenzyl)oxy]-2-[(1E)-1-methyl-1-propenyl]cyclohexanol
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C26H34O5
InChI InChI=1S/C26H34O5/c1-5-18(2)25-23(27)14-15-24(30-16-19-6-10-21(28-3)11-7-19)26(25)31-17-20-8-12-22(29-4)13-9-20/h5-13,23-27H,14-17H2,1-4H3/b18-5+/t23-,24+,25-,26-/m1/s1
InChIKey FJJQCYKJNPZSDN-ZMXYDZBPSA-N
Molecular Weight 426.553 g/mol
SMILES O[C@]1([C@]([C@](OCc2ccc(cc2)OC)([C@@](OCc2ccc(cc2)OC)(CC1)[H])[H])(\C(=C\C)C)[H])[H]
SPLASH splash10-0a4i-0009000000-c97bb96a382ee103cb41
Source of Spectrum F-55-2220-40
Wiley ID 836987