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C6H4-3-ME(H)C=C(H)C(O)ME
SpectraBase Compound ID JTnDXMXEPcb
InChI InChI=1S/C11H12O/c1-9-4-3-5-11(8-9)7-6-10(2)12/h3-8H,1-2H3/b7-6+
InChIKey MMKNUEPXVVBSGX-VOTSOKGWSA-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 JiFlZItrNkn
Name 3-Buten-2-one, 4-(3-methylphenyl)-
CAS Registry Number 15753-84-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H12O
InChI InChI=1S/C11H12O/c1-9-4-3-5-11(8-9)7-6-10(2)12/h3-8H,1-2H3/b7-6+
InChIKey MMKNUEPXVVBSGX-VOTSOKGWSA-N
Molecular Weight 160.216 g/mol
SMILES c1(\C=C\C(=O)C)cc(C)ccc1
SPLASH splash10-014j-3900000000-a40b7a558c299577f3c7
Source of Spectrum 0-16-412-1
Synonyms (E)-4-(3-methylphenyl)-3-buten-2-one (E)-4-(3-methylphenyl)but-3-en-2-one (E)-4-(m-tolyl)but-3-en-2-one 3-Methylbenzalacetone
Wiley ID 1157121