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4H-1-Benzopyran-4-one, 3-[4-methoxy-2-[[(4-methylphenyl)sulfonyl]oxy]phenyl]-7-[[(4-methylphenyl)sulfonyl]oxy]-
SpectraBase Compound ID IQaOHzGMd3H
InChI InChI=1S/C30H24O9S2/c1-19-4-10-23(11-5-19)40(32,33)38-22-9-15-26-28(17-22)37-18-27(30(26)31)25-14-8-21(36-3)16-29(25)39-41(34,35)24-12-6-20(2)7-13-24/h4-18H,1-3H3
InChIKey HDRCMKPWRZTDPK-UHFFFAOYSA-N
Mol Weight 592.63 g/mol
Molecular Formula C30H24O9S2
Exact Mass 592.086175 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LINuNI9rHQq
Name 4H-1-Benzopyran-4-one, 3-[4-methoxy-2-[[(4-methylphenyl)sulfonyl]oxy]phenyl]-7-[[(4-methylphenyl)sulfonyl]oxy]-
CAS Registry Number 113434-78-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C30H24O9S2
InChI InChI=1S/C30H24O9S2/c1-19-4-10-23(11-5-19)40(32,33)38-22-9-15-26-28(17-22)37-18-27(30(26)31)25-14-8-21(36-3)16-29(25)39-41(34,35)24-12-6-20(2)7-13-24/h4-18H,1-3H3
InChIKey HDRCMKPWRZTDPK-UHFFFAOYSA-N
Molecular Weight 592.633 g/mol
SMILES c1(OS(c2ccc(cc2)C)(=O)=O)c(C=2C(c3ccc(OS(c4ccc(cc4)C)(=O)=O)cc3OC2)=O)ccc(c1)OC
SPLASH splash10-00dl-4210900000-65c7b9e1a0e4448c5310
Source of Spectrum KC-1987-1084-4
Synonyms 4'-Methoxy-2',7-ditosyloxyisoflavone 5-Methoxy-2-(7-{[(4-methylphenyl)sulfonyl]oxy}-4-oxo-4H-chromen-3-yl)phenyl 4-methylbenzenesulfonate
Wiley ID 1409468