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2H-1-Benzopyran-3,4-diol, 2-(3,4-dimethoxyphenyl)-3,4-dihydro-7,8-dimethoxy-, diacetate, [2R-(2.alpha.,3.alpha.,4.alpha.)]-
SpectraBase Compound ID AEQw8aFsCIX
InChI InChI=1S/C23H26O9/c1-12(24)30-21-15-8-10-17(27-4)22(29-6)20(15)32-19(23(21)31-13(2)25)14-7-9-16(26-3)18(11-14)28-5/h7-11,19,21,23H,1-6H3
InChIKey BSMSXNNOCRXXHE-UHFFFAOYSA-N
Mol Weight 446.45 g/mol
Molecular Formula C23H26O9
Exact Mass 446.157682 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EOEpJJqeY53
Name 2H-1-Benzopyran-3,4-diol, 2-(3,4-dimethoxyphenyl)-3,4-dihydro-7,8-dimethoxy-, diacetate, [2R-(2.alpha.,3.alpha.,4.alpha.)]-
CAS Registry Number 72150-29-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H26O9
InChI InChI=1S/C23H26O9/c1-12(24)30-21-15-8-10-17(27-4)22(29-6)20(15)32-19(23(21)31-13(2)25)14-7-9-16(26-3)18(11-14)28-5/h7-11,19,21,23H,1-6H3
InChIKey BSMSXNNOCRXXHE-UHFFFAOYSA-N
Molecular Weight 446.452 g/mol
SMILES CC(=O)OC1c2ccc(c(c2OC(c2ccc(c(c2)OC)OC)C1OC(C)=O)OC)OC
SPLASH splash10-00o0-0913000000-8f8551b5d31f147e9bc0
Source of Spectrum B-21-3043-32
Synonyms 3-(Acetyloxy)-2-(3,4-dimethoxyphenyl)-7,8-dimethoxy-3,4-dihydro-2H-chromen-4-yl acetate Acetic acid [4-acetyloxy-2-(3,4-dimethoxyphenyl)-7,8-dimethoxy-3,4-dihydro-2H-1-benzopyran-3-yl] ester [4-acetyloxy-2-(3,4-dimethoxyphenyl)-7,8-dimethoxy-3,4-dihydro-2H-chromen-3-yl] acetate [4-acetoxy-2-(3,4-dimethoxyphenyl)-7,8-dimethoxy-chroman-3-yl] acetate [4-acetyloxy-2-(3,4-dimethoxyphenyl)-7,8-dimethoxy-3,4-dihydro-2H-chromen-3-yl] ethanoate
Wiley ID 1386557