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3-Buten-2-one, 4-(2-methylphenyl)-
SpectraBase Compound ID 3lFqpgcRWMW
InChI InChI=1S/C11H12O/c1-9-5-3-4-6-11(9)8-7-10(2)12/h3-8H,1-2H3/b8-7+
InChIKey WPSNJCPNIUVDHW-BQYQJAHWSA-N
Mol Weight 160.22 g/mol
Molecular Formula C11H12O
Exact Mass 160.088815 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2ySHXJdq7c0
Name 3-Buten-2-one, 4-(2-methylphenyl)-
CAS Registry Number 16927-82-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H12O
InChI InChI=1S/C11H12O/c1-9-5-3-4-6-11(9)8-7-10(2)12/h3-8H,1-2H3/b8-7+
InChIKey WPSNJCPNIUVDHW-BQYQJAHWSA-N
Molecular Weight 160.216 g/mol
SMILES C(\C=C\c1c(C)cccc1)(=O)C
SPLASH splash10-00kb-2900000000-89e78273e1023b04b6aa
Source of Spectrum 0-16-412-1
Synonyms (E)-4-(2-methylphenyl)-3-buten-2-one (E)-4-(2-methylphenyl)but-3-en-2-one (E)-4-(o-tolyl)but-3-en-2-one 4-(2-Methylphenyl)-but-3-en-2-one
Wiley ID 1157120