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3-[(E)-3-(3-methoxy-4-oxidanyl-phenyl)prop-2-enyl]pentane-2,4-dione
SpectraBase Compound ID DomurIrYXWw
InChI InChI=1S/C15H18O4/c1-10(16)13(11(2)17)6-4-5-12-7-8-14(18)15(9-12)19-3/h4-5,7-9,13,18H,6H2,1-3H3/b5-4+
InChIKey YSGAEDGEXZISSH-SNAWJCMRSA-N
Mol Weight 262.3 g/mol
Molecular Formula C15H18O4
Exact Mass 262.120509 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FafbyyPshER
Name 3-[(E)-3-(3-methoxy-4-oxidanyl-phenyl)prop-2-enyl]pentane-2,4-dione
CAS Registry Number 94930-96-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H18O4
InChI InChI=1S/C15H18O4/c1-10(16)13(11(2)17)6-4-5-12-7-8-14(18)15(9-12)19-3/h4-5,7-9,13,18H,6H2,1-3H3/b5-4+
InChIKey YSGAEDGEXZISSH-SNAWJCMRSA-N
Molecular Weight 262.305 g/mol
SMILES Oc1ccc(cc1OC)\C=C\CC(C(=O)C)C(=O)C
SPLASH splash10-00kr-0970000000-d6987db6b98302099508
Source of Spectrum J-50-945-0
Synonyms 3-[(E)-3-(4-hydroxy-3-methoxy-phenyl)allyl]pentane-2,4-dione 3-[(E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enyl]pentane-2,4-dione
Wiley ID 1265874