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2-Anthracenecarboxylic acid, 3,4,4a,9,9a,10-hexahydro-10-oxo-4a-(3-phenyl-1-propenyl)-, methyl ester
SpectraBase Compound ID 5YpsFh5AKQh
InChI InChI=1S/C25H24O3/c1-28-24(27)20-13-15-25(14-7-10-18-8-3-2-4-9-18)21(17-20)16-19-11-5-6-12-22(19)23(25)26/h2-9,11-12,14,17,21H,10,13,15-16H2,1H3/b14-7+
InChIKey CNZKBOUFKMPPEJ-VGOFMYFVSA-N
Mol Weight 372.46 g/mol
Molecular Formula C25H24O3
Exact Mass 372.172545 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B0RQAIjCuD1
Name 2-Anthracenecarboxylic acid, 3,4,4a,9,9a,10-hexahydro-10-oxo-4a-(3-phenyl-1-propenyl)-, methyl ester
CAS Registry Number 115205-33-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H24O3
InChI InChI=1S/C25H24O3/c1-28-24(27)20-13-15-25(14-7-10-18-8-3-2-4-9-18)21(17-20)16-19-11-5-6-12-22(19)23(25)26/h2-9,11-12,14,17,21H,10,13,15-16H2,1H3/b14-7+
InChIKey CNZKBOUFKMPPEJ-VGOFMYFVSA-N
Molecular Weight 372.464 g/mol
SMILES C12(C(c3ccccc3CC2C=C(CC1)C(=O)OC)=O)\C=C\Cc1ccccc1
SPLASH splash10-00yi-4698000000-62431531ef9a834cee08
Source of Spectrum J-53-3708-6
Synonyms 5-Oxo-5a-(3'-phenyl1'-propenyl)-8-methoxycarbonyl-5a,6,7,9a,10-pentahydro-anthracene Methyl 10-oxo-4a-[(1E)-3-phenyl-1-propenyl]-3,4,4a,9,9a,10-hexahydro-2-anthracenecarboxylate
Wiley ID 1355845