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GINGERENONE-A
SpectraBase Compound ID JgTGt2wyFUx
InChI InChI=1S/C21H24O5/c1-25-20-13-15(8-11-18(20)23)5-3-4-6-17(22)10-7-16-9-12-19(24)21(14-16)26-2/h4,6,8-9,11-14,23-24H,3,5,7,10H2,1-2H3/b6-4+
InChIKey FWDXZNKYDTXGOT-GQCTYLIASA-N
Mol Weight 356.42 g/mol
Molecular Formula C21H24O5
Exact Mass 356.162374 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7F3Qnz6HIw7
Name (E)-1,7-bis(3-methoxy-4-oxidanyl-phenyl)hept-4-en-3-one
CAS Registry Number 128700-97-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H24O5
InChI InChI=1S/C21H24O5/c1-25-20-13-15(8-11-18(20)23)5-3-4-6-17(22)10-7-16-9-12-19(24)21(14-16)26-2/h4,6,8-9,11-14,23-24H,3,5,7,10H2,1-2H3/b6-4+
InChIKey FWDXZNKYDTXGOT-GQCTYLIASA-N
Molecular Weight 356.418 g/mol
SMILES Oc1c(cc(CC\C=C\C(CCc2cc(c(cc2)O)OC)=O)cc1)OC
SPLASH splash10-000i-0902000000-07b0db740ea8e431385d
Source of Spectrum E1-39-122-1
Synonyms 1,7-Bis(4-hydroxy-3-methoxyphenyl)hept-4-en-3-one (E)-1,7-bis(4-hydroxy-3-methoxy-phenyl)hept-4-en-3-one (E)-1,7-bis(4-hydroxy-3-methoxyphenyl)-4-hepten-3-one
Wiley ID 1518734