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(E)-4-(4'-Acetoxyphenyl)-3-buten-2-one
SpectraBase Compound ID LOLOXT9klIc
InChI InChI=1S/C12H12O3/c1-9(13)3-4-11-5-7-12(8-6-11)15-10(2)14/h3-8H,1-2H3/b4-3+
InChIKey JFNKSNPDSGPDLG-ONEGZZNKSA-N
Mol Weight 204.22 g/mol
Molecular Formula C12H12O3
Exact Mass 204.078644 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2bzGuQfrcW
Name (E)-4-(4'-Acetoxyphenyl)-3-buten-2-one
Alternate Name(s) (E)-4-(3-oxobut-1-en-1-yl)phenyl acetate Acetic acid [4-[(E)-3-oxobut-1-enyl]phenyl] ester [4-[(E)-3-oxobut-1-enyl]phenyl] acetate [4-[(E)-3-oxidanylidenebut-1-enyl]phenyl] ethanoate
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Formula C12H12O3
InChI InChI=1S/C12H12O3/c1-9(13)3-4-11-5-7-12(8-6-11)15-10(2)14/h3-8H,1-2H3/b4-3+
InChIKey JFNKSNPDSGPDLG-ONEGZZNKSA-N
Literature Reference DOI 10.1002/adsc.200900902
Molecular Weight 204.225 g/mol
SMILES c1cc(ccc1OC(C)=O)\C=C\C(C)=O
SPLASH splash10-000m-2910000000-0d4dc56166a969b650fe
Source of Spectrum ASC-352-1135/SM7-4e
Wiley ID 1764397