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1,4-Butanediol, 2-[(3,4-dimethoxyphenyl)methyl]-3-[(4-hydroxy-3-methoxyphenyl)methyl]-, 1,4-diacetate, [R-(R*,R*)]-

View entire compound with spectra: 1 MS (GC)

1,4-Butanediol, 2-[(3,4-dimethoxyphenyl)methyl]-3-[(4-hydroxy-3-methoxyphenyl)methyl]-, 1,4-diacetate, [R-(R*,R*)]-
SpectraBase Compound ID KijQPvB91uV
InChI InChI=1S/C25H32O8/c1-16(26)32-14-20(10-18-6-8-22(28)24(12-18)30-4)21(15-33-17(2)27)11-19-7-9-23(29-3)25(13-19)31-5/h6-9,12-13,20-21,28H,10-11,14-15H2,1-5H3/t20-,21-/m0/s1
InChIKey OXMLPPRSPAFHFU-SFTDATJTSA-N
Mol Weight 460.5 g/mol
Molecular Formula C25H32O8
Exact Mass 460.209718 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Fk4MFmNeoIq
Name 1,4-Butanediol, 2-[(3,4-dimethoxyphenyl)methyl]-3-[(4-hydroxy-3-methoxyphenyl)methyl]-, 1,4-diacetate, [R-(R*,R*)]-
Alternate Name(s) (2R,3R)-4-(acetyloxy)-2-(3,4-dimethoxybenzyl)-3-(4-hydroxy-3-methoxybenzyl)butyl acetate (8R,8'R)-4'-hydroxy-3,3',4-trimethoxylignan-9,9'-diyl diacetate Acetic acid[(2R,3R)-3-(acetoxymethyl)-4-(3,4-dimethoxyphenyl)-2-vanillyl-butyl]ester Acetic acid[(2R,3R)-3-(acetyloxymethyl)-4-(3,4-dimethoxyphenyl)-2-[(4-hydroxy-3-methoxyphenyl)methyl]butyl]ester [(2R,3R)-3-(acetoxymethyl)-4-(3,4-dimethoxyphenyl)-2-[(4-hydroxy-3-methoxy-phenyl)methyl]butyl]acetate [(2R,3R)-3-(acetyloxymethyl)-4-(3,4-dimethoxyphenyl)-2-[(3-methoxy-4-oxidanyl-phenyl)methyl]butyl]ethanoate [(2R,3R)-3-(acetyloxymethyl)-4-(3,4-dimethoxyphenyl)-2-[(4-hydroxy-3-methoxyphenyl)methyl]butyl]acetate Acetic acid [(2R,3R)-3-(acetyloxymethyl)-4-(3,4-dimethoxyphenyl)-2-[(4-hydroxy-3-methoxyphenyl)methyl]butyl] ester [(2R,3R)-3-(acetyloxymethyl)-4-(3,4-dimethoxyphenyl)-2-[(4-hydroxy-3-methoxyphenyl)methyl]butyl] acetate [(2R,3R)-3-(acetoxymethyl)-4-(3,4-dimethoxyphenyl)-2-[(4-hydroxy-3-methoxy-phenyl)methyl]butyl] acetate [(2R,3R)-3-(acetyloxymethyl)-4-(3,4-dimethoxyphenyl)-2-[(3-methoxy-4-oxidanyl-phenyl)methyl]butyl] ethanoate
CAS Registry Number 73354-11-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H32O8
InChI InChI=1S/C25H32O8/c1-16(26)32-14-20(10-18-6-8-22(28)24(12-18)30-4)21(15-33-17(2)27)11-19-7-9-23(29-3)25(13-19)31-5/h6-9,12-13,20-21,28H,10-11,14-15H2,1-5H3/t20-,21-/m0/s1
InChIKey OXMLPPRSPAFHFU-SFTDATJTSA-N
Molecular Weight 460.523 g/mol
SMILES Oc1c(cc(C[C@]([C@@](Cc2cc(OC)c(cc2)OC)(COC(=O)C)[H])(COC(=O)C)[H])cc1)OC
SPLASH splash10-0udr-1900200000-61d9772466748c20b7c5
Source of Spectrum B-41-931-35
Wiley ID 1390481