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1,4-bis(4-benzyloxy-3,5-dimethoxyphenyl)-2,3-dimethylbut-2-ene (1.3:1 (E)/(Z) mixture)
SpectraBase Compound ID 91JAQKmoIM8
InChI InChI=1S/C36H40O6/c1-25(17-29-19-31(37-3)35(32(20-29)38-4)41-23-27-13-9-7-10-14-27)26(2)18-30-21-33(39-5)36(34(22-30)40-6)42-24-28-15-11-8-12-16-28/h7-16,19-22H,17-18,23-24H2,1-6H3/b26-25+
InChIKey ITLVYNROPCYYCJ-OCEACIFDSA-N
Mol Weight 568.7 g/mol
Molecular Formula C36H40O6
Exact Mass 568.282489 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID YsqZnyDb93
Name 1,4-bis(4-benzyloxy-3,5-dimethoxyphenyl)-2,3-dimethylbut-2-ene (1.3:1 (E)/(Z) mixture)
Alternate Name(s) 2-(benzyloxy)-5-{(2E)-4-[4-(benzyloxy)-3,5-dimethoxyphenyl]-2,3-dimethyl-2-butenyl}-1,3-dimethoxybenzene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C36H40O6
InChI InChI=1S/C36H40O6/c1-25(17-29-19-31(37-3)35(32(20-29)38-4)41-23-27-13-9-7-10-14-27)26(2)18-30-21-33(39-5)36(34(22-30)40-6)42-24-28-15-11-8-12-16-28/h7-16,19-22H,17-18,23-24H2,1-6H3/b26-25+
InChIKey ITLVYNROPCYYCJ-OCEACIFDSA-N
Molecular Weight 568.710 g/mol
SMILES c1(c(cc(cc1OC)C\C(=C\(Cc1cc(OC)c(c(c1)OC)OCc1ccccc1)C)C)OC)OCc1ccccc1
SPLASH splash10-00kf-5940320000-ea8be7beb089e0d9b29d
Source of Spectrum B-46-277-0
Wiley ID 1407566