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(E)-2-acetyl-2-methyl-4-phenyl-3-butenoic acid ethyl ester
SpectraBase Compound ID 1hxwJ77QqtR
InChI InChI=1S/C15H18O3/c1-4-18-14(17)15(3,12(2)16)11-10-13-8-6-5-7-9-13/h5-11H,4H2,1-3H3/b11-10+
InChIKey JXNMJJRPEJTCRF-ZHACJKMWSA-N
Mol Weight 246.31 g/mol
Molecular Formula C15H18O3
Exact Mass 246.125594 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HZ6cm4lx7dx
Name (E)-2-acetyl-2-methyl-4-phenyl-3-butenoic acid ethyl ester
Alternate Name(s) (E)-2-acetyl-2-methyl-4-phenyl-but-3-enoic acid ethyl ester ethyl (E)-2-acetyl-2-methyl-4-phenyl-but-3-enoate ethyl (E)-2-ethanoyl-2-methyl-4-phenyl-but-3-enoate
CAS Registry Number 94530-23-1
Comments Less than 3 mono-isotopic peaks
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Formula C15H18O3
InChI InChI=1S/C15H18O3/c1-4-18-14(17)15(3,12(2)16)11-10-13-8-6-5-7-9-13/h5-11H,4H2,1-3H3/b11-10+
InChIKey JXNMJJRPEJTCRF-ZHACJKMWSA-N
Molecular Weight 246.306 g/mol
SMILES C(\C=C\c1ccccc1)(C(=O)OCC)(C(=O)C)C
SPLASH splash10-0udi-0090000000-0b3d24aa75e2888f6e92
Source of Spectrum KC-1988-2853-30
Wiley ID 1249224