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(E)-4-Phenyl-3-pentanoyloxymethyl-3-buten-2-one
SpectraBase Compound ID IQfCJj4XYY8
InChI InChI=1S/C16H20O3/c1-3-4-10-16(18)19-12-15(13(2)17)11-14-8-6-5-7-9-14/h5-9,11H,3-4,10,12H2,1-2H3/b15-11+
InChIKey SKSSNGMLOWGAAI-RVDMUPIBSA-N
Mol Weight 260.33 g/mol
Molecular Formula C16H20O3
Exact Mass 260.141245 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8fo5jH3upLt
Name (E)-4-Phenyl-3-pentanoyloxymethyl-3-buten-2-one
Alternate Name(s) (E)-2-benzylidene-3-oxobutyl pentanoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H20O3
InChI InChI=1S/C16H20O3/c1-3-4-10-16(18)19-12-15(13(2)17)11-14-8-6-5-7-9-14/h5-9,11H,3-4,10,12H2,1-2H3/b15-11+
InChIKey SKSSNGMLOWGAAI-RVDMUPIBSA-N
Literature Reference DOI 10.1002/adsc.201600601
Molecular Weight 260.333 g/mol
SMILES CC(\C(=C\c1ccccc1)COC(CCCC)=O)=O
SPLASH splash10-056r-3900000000-f85a3445c4c7e1d14a4d
Source of Spectrum ASC-358-3567-13c
Wiley ID 1803410