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(4S,5S,6S)-4-[(1E)-1,5-dimethyl-1,4-hexadienyl]-5,6-bis[(4-methoxybenzyl)oxy]-1-oxaspiro[2.5]octane

View entire compound with spectra: 1 MS (GC)

(4S,5S,6S)-4-[(1E)-1,5-dimethyl-1,4-hexadienyl]-5,6-bis[(4-methoxybenzyl)oxy]-1-oxaspiro[2.5]octane
SpectraBase Compound ID 768r3DdAmtw
InChI InChI=1S/C31H40O5/c1-22(2)7-6-8-23(3)29-30(35-20-25-11-15-27(33-5)16-12-25)28(17-18-31(29)21-36-31)34-19-24-9-13-26(32-4)14-10-24/h7-16,28-30H,6,17-21H2,1-5H3/b23-8+/t28-,29-,30+,31?/m0/s1
InChIKey ZALHCCYXRQWJAY-ZGFQXZSBSA-N
Mol Weight 492.7 g/mol
Molecular Formula C31H40O5
Exact Mass 492.287574 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LZmNucJHLCw
Name (4S,5S,6S)-4-[(1E)-1,5-dimethyl-1,4-hexadienyl]-5,6-bis[(4-methoxybenzyl)oxy]-1-oxaspiro[2.5]octane
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C31H40O5
InChI InChI=1S/C31H40O5/c1-22(2)7-6-8-23(3)29-30(35-20-25-11-15-27(33-5)16-12-25)28(17-18-31(29)21-36-31)34-19-24-9-13-26(32-4)14-10-24/h7-16,28-30H,6,17-21H2,1-5H3/b23-8+/t28-,29-,30+,31?/m0/s1
InChIKey ZALHCCYXRQWJAY-ZGFQXZSBSA-N
Molecular Weight 492.656 g/mol
SMILES C12(OC2)[C@]([C@](OCc2ccc(cc2)OC)([C@](CC1)(OCc1ccc(cc1)OC)[H])[H])(\C(=C\CC=C(C)C)C)[H]
SPLASH splash10-00di-0900000000-3a15cdd3a736ac9d8cc5
Source of Spectrum F-55-2218-38
Synonyms (4S,5S,6S)-4-{(1E)-1,5-Dimethylhexa-1,4-dien-1-y})-5,6-di(4-methoxybenzyl)-1-oxaspiro[2.5]octane
Wiley ID 836988