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1,7-bis(p-Acetoxyphenyl)-3-hydroxy-1,3-heptadien-5-one
SpectraBase Compound ID 7t3ruhy2S1C
InChI InChI=1S/C23H22O6/c1-16(24)28-22-11-5-18(6-12-22)3-9-20(26)15-21(27)10-4-19-7-13-23(14-8-19)29-17(2)25/h3,5-9,11-15,26H,4,10H2,1-2H3/b9-3+,20-15-
InChIKey DGFMYBUOEWHQGH-RFVIWUTBSA-N
Mol Weight 394.42 g/mol
Molecular Formula C23H22O6
Exact Mass 394.141638 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Jn7UIinyR7a
Name 1,7-bis(p-Acetoxyphenyl)-3-hydroxy-1,3-heptadien-5-one
Alternate Name(s) 4-{(1E,3Z)-7-[4-(acetyloxy)phenyl]-3-hydroxy-5-oxo-1,3-heptadienyl}phenyl acetate Acetic acid[4-[(4Z,6E)-7-(4-acetoxyphenyl)-5-hydroxy-3-keto-hepta-4,6-dienyl]phenyl]ester Acetic acid[4-[(4Z,6E)-7-(4-acetyloxyphenyl)-5-hydroxy-3-oxohepta-4,6-dienyl]phenyl]ester [4-[(4Z,6E)-7-(4-acetoxyphenyl)-5-hydroxy-3-oxo-hepta-4,6-dienyl]phenyl]acetate [4-[(4Z,6E)-7-(4-acetyloxyphenyl)-5-hydroxy-3-oxohepta-4,6-dienyl]phenyl]acetate [4-[(4Z,6E)-7-(4-acetyloxyphenyl)-5-oxidanyl-3-oxidanylidene-hepta-4,6-dienyl]phenyl]ethanoate Acetic acid [4-[(4Z,6E)-7-(4-acetyloxyphenyl)-5-hydroxy-3-oxohepta-4,6-dienyl]phenyl] ester [4-[(4Z,6E)-7-(4-acetyloxyphenyl)-5-hydroxy-3-oxohepta-4,6-dienyl]phenyl] acetate [4-[(4Z,6E)-7-(4-acetoxyphenyl)-5-hydroxy-3-oxo-hepta-4,6-dienyl]phenyl] acetate [4-[(4Z,6E)-7-(4-acetyloxyphenyl)-5-oxidanyl-3-oxidanylidene-hepta-4,6-dienyl]phenyl] ethanoate
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Formula C23H22O6
InChI InChI=1S/C23H22O6/c1-16(24)28-22-11-5-18(6-12-22)3-9-20(26)15-21(27)10-4-19-7-13-23(14-8-19)29-17(2)25/h3,5-9,11-15,26H,4,10H2,1-2H3/b9-3+,20-15-
InChIKey DGFMYBUOEWHQGH-RFVIWUTBSA-N
Molecular Weight 394.423 g/mol
SMILES O\C(\C=C\c1ccc(cc1)OC(=O)C)=C/C(CCc1ccc(cc1)OC(=O)C)=O
SPLASH splash10-0gvp-2945000000-439e8bafd587e0d6a89e
Source of Spectrum G4-61-143-1
Wiley ID 1607126