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3-Phenylpropionic acid (5-hydrocinnamoyloxy-9,10-diketo-1-anthryl) ester
SpectraBase Compound ID AKmCHZbUqfr
InChI InChI=1S/C32H24O6/c33-27(19-17-21-9-3-1-4-10-21)37-25-15-7-13-23-29(25)31(35)24-14-8-16-26(30(24)32(23)36)38-28(34)20-18-22-11-5-2-6-12-22/h1-16H,17-20H2
InChIKey BQGVJVRJILNULA-UHFFFAOYSA-N
Mol Weight 504.5 g/mol
Molecular Formula C32H24O6
Exact Mass 504.157288 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 353xjGIT5xv
Name 3-Phenylpropionic acid (5-hydrocinnamoyloxy-9,10-diketo-1-anthryl) ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C32H24O6
InChI InChI=1S/C32H24O6/c33-27(19-17-21-9-3-1-4-10-21)37-25-15-7-13-23-29(25)31(35)24-14-8-16-26(30(24)32(23)36)38-28(34)20-18-22-11-5-2-6-12-22/h1-16H,17-20H2
InChIKey BQGVJVRJILNULA-UHFFFAOYSA-N
Molecular Weight 504.538 g/mol
SMILES c12C(c3cccc(c3C(c2cccc1OC(=O)CCc1ccccc1)=O)OC(=O)CCc1ccccc1)=O
SPLASH splash10-0006-0090000000-43c927e29269f6381f97
Source of Spectrum D9-335-485-2
Synonyms 3-Phenylpropanoic acid [9,10-dioxo-5-(1-oxo-3-phenylpropoxy)-1-anthracenyl] ester [9,10-dioxo-5-(3-phenylpropanoyloxy)anthracen-1-yl] 3-phenylpropanoate [9,10-dioxo-5-(3-phenylpropanoyloxy)-1-anthryl] 3-phenylpropanoate
Wiley ID 1551011