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Acetic acid 3,5-Diacetoxy-2-(2,2-diphernylbenzo[1,3]dioxol-5-yl)chroman-7-yl ester
SpectraBase Compound ID 9K8Ie10Y5GB
InChI InChI=1S/C34H28O9/c1-20(35)38-26-17-29(39-21(2)36)27-19-32(40-22(3)37)33(41-30(27)18-26)23-14-15-28-31(16-23)43-34(42-28,24-10-6-4-7-11-24)25-12-8-5-9-13-25/h4-18,32-33H,19H2,1-3H3/t32-,33+/m0/s1
InChIKey GCXMDUNTXALJOD-JHOUSYSJSA-N
Mol Weight 580.6 g/mol
Molecular Formula C34H28O9
Exact Mass 580.173332 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5xsivGXnogy
Name Acetic acid 3,5-Diacetoxy-2-(2,2-diphernylbenzo[1,3]dioxol-5-yl)chroman-7-yl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C34H28O9
InChI InChI=1S/C34H28O9/c1-20(35)38-26-17-29(39-21(2)36)27-19-32(40-22(3)37)33(41-30(27)18-26)23-14-15-28-31(16-23)43-34(42-28,24-10-6-4-7-11-24)25-12-8-5-9-13-25/h4-18,32-33H,19H2,1-3H3/t32-,33+/m0/s1
InChIKey GCXMDUNTXALJOD-JHOUSYSJSA-N
Molecular Weight 580.589 g/mol
SMILES C1(Oc2cc([C@]3(Oc4cc(OC(=O)C)cc(c4C[C@@]3(OC(=O)C)[H])OC(=O)C)[H])ccc2O1)(c1ccccc1)c1ccccc1
SPLASH splash10-03xr-0234950000-11f94f933af28f397c83
Source of Spectrum K-2002-827-9
Synonyms Acetic acid [(2R,3S)-5,7-diacetyloxy-2-(2,2-diphenyl-1,3-benzodioxol-5-yl)-3,4-dihydro-2H-1-benzopyran-3-yl] ester [(2R,3S)-5,7-diacetyloxy-2-(2,2-diphenyl-1,3-benzodioxol-5-yl)-3,4-dihydro-2H-chromen-3-yl] acetate [(2R,3S)-5,7-diacetoxy-2-(2,2-diphenyl-1,3-benzodioxol-5-yl)chroman-3-yl] acetate [(2R,3S)-5,7-diacetyloxy-2-(2,2-diphenyl-1,3-benzodioxol-5-yl)-3,4-dihydro-2H-chromen-3-yl] ethanoate
Wiley ID 1581105