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2-Buten-1-one, 1-(2-hydroxy-5-methylphenyl)-
SpectraBase Compound ID JF9EaFm6YYL
InChI InChI=1S/C11H12O2/c1-3-4-10(12)9-7-8(2)5-6-11(9)13/h3-7,13H,1-2H3/b4-3+
InChIKey OKPZKERIUKBJIH-ONEGZZNKSA-N
Mol Weight 176.21 g/mol
Molecular Formula C11H12O2
Exact Mass 176.08373 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Bjq4ottyk56
Name 2-Buten-1-one, 1-(2-hydroxy-5-methylphenyl)-
CAS Registry Number 5631-63-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H12O2
InChI InChI=1S/C11H12O2/c1-3-4-10(12)9-7-8(2)5-6-11(9)13/h3-7,13H,1-2H3/b4-3+
InChIKey OKPZKERIUKBJIH-ONEGZZNKSA-N
Molecular Weight 176.215 g/mol
SMILES Oc1c(C(\C=C\C)=O)cc(cc1)C
SPLASH splash10-03di-3900000000-d6204fda33bf41028913
Source of Spectrum EP-6694-0-0
Synonyms Crotonophenone, 2'-hydroxy-5'-methyl- (2E)-1-(2-Hydroxy-5-methylphenyl)-2-buten-1-one (E)-1-(2-hydroxy-5-methyl-phenyl)but-2-en-1-one (E)-1-(2-hydroxy-5-methylphenyl)-2-buten-1-one (E)-1-(5-methyl-2-oxidanyl-phenyl)but-2-en-1-one
Wiley ID 1172383