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(+)-(3S,5E)-7-[4-(Benzyloxy)phenyl]-1-(4-methoxyphenyl)hept-5-en-3-ol

View entire compound with spectra: 1 MS (GC)

(+)-(3S,5E)-7-[4-(Benzyloxy)phenyl]-1-(4-methoxyphenyl)hept-5-en-3-ol
SpectraBase Compound ID GvaV9UJht76
InChI InChI=1S/C27H30O3/c1-29-26-17-12-23(13-18-26)11-16-25(28)10-6-5-7-22-14-19-27(20-15-22)30-21-24-8-3-2-4-9-24/h2-6,8-9,12-15,17-20,25,28H,7,10-11,16,21H2,1H3/b6-5+/t25-/m1/s1
InChIKey MOMFPLINWLLZHR-GJCNFQEQSA-N
Mol Weight 402.53 g/mol
Molecular Formula C27H30O3
Exact Mass 402.219495 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FpfOmDyMKsF
Name (+)-(3S,5E)-7-[4-(Benzyloxy)phenyl]-1-(4-methoxyphenyl)hept-5-en-3-ol
Alternate Name(s) (+)-(5E)-4''-O-(Benzyloxy)-5,6-didehydro-4'-O-methylisocentrolobol (S,E)-7-(4-(benzyloxy)phenyl)-1-(4-methoxyphenyl)hept-5-en-3-ol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H30O3
InChI InChI=1S/C27H30O3/c1-29-26-17-12-23(13-18-26)11-16-25(28)10-6-5-7-22-14-19-27(20-15-22)30-21-24-8-3-2-4-9-24/h2-6,8-9,12-15,17-20,25,28H,7,10-11,16,21H2,1H3/b6-5+/t25-/m1/s1
InChIKey MOMFPLINWLLZHR-GJCNFQEQSA-N
Literature Reference DOI 10.1002/hlca.201000097
Molecular Weight 402.534 g/mol
SMILES O[C@@](CCc1ccc(OC)cc1)(C\C=C\Cc1ccc(cc1)OCc1ccccc1)[H]
SPLASH splash10-006x-9610000000-19e7e7a24aad0389e7d5
Source of Spectrum H-93-1309-(_)_10
Wiley ID 1784005