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Ganbajunin A

View entire compound with spectra: 2 MS (GC)

Ganbajunin A
SpectraBase Compound ID 2BiYg1ueiKs
InChI InChI=1S/C43H32O9/c1-49-42-38(31-17-21-33(22-18-31)50-35(44)25-28-11-5-2-6-12-28)41(48)43(52-37(46)27-30-15-9-4-10-16-30)39(40(42)47)32-19-23-34(24-20-32)51-36(45)26-29-13-7-3-8-14-29/h2-24H,25-27H2,1H3
InChIKey RTONZZNCUQSUBC-UHFFFAOYSA-N
Mol Weight 692.7 g/mol
Molecular Formula C43H32O9
Exact Mass 692.204633 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DKk9etSQRZV
Name Ganbajunin A
Alternate Name(s) 5'-Methoxy-3,6'-dioxo{[1,1' : 4',1'']-terphenyl}-2',4,4''-triyl tris(2-phenylacetate) Phenyl-acetic acid 4-methoxy-3,6-dioxo-2,5-bis-(4-phenylacetoxy-phenyl)-cyclohexa-1,4-dienyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C43H32O9
InChI InChI=1S/C43H32O9/c1-49-42-38(31-17-21-33(22-18-31)50-35(44)25-28-11-5-2-6-12-28)41(48)43(52-37(46)27-30-15-9-4-10-16-30)39(40(42)47)32-19-23-34(24-20-32)51-36(45)26-29-13-7-3-8-14-29/h2-24H,25-27H2,1H3
InChIKey RTONZZNCUQSUBC-UHFFFAOYSA-N
Molecular Weight 692.720 g/mol
SMILES C1(=C(C(=O)C(=C(C1=O)c1ccc(OC(=O)Cc2ccccc2)cc1)OC)c1ccc(OC(=O)Cc2ccccc2)cc1)OC(=O)Cc1ccccc1
SPLASH splash10-00lf-4759000000-6d99d56fb39dfefe6e25
Source of Spectrum H-84-3348-2
Wiley ID 847773