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Ethyl (Z)-3-methyl-3-[4'-(4"-oxopentyl)phenyl]prop-2-enoate
SpectraBase Compound ID 2kUKZx8uEgw
InChI InChI=1S/C17H22O3/c1-4-20-17(19)12-13(2)16-11-6-5-9-15(16)10-7-8-14(3)18/h5-6,9,11-12H,4,7-8,10H2,1-3H3/b13-12+
InChIKey UMSGNAQMXRMGAW-OUKQBFOZSA-N
Mol Weight 274.36 g/mol
Molecular Formula C17H22O3
Exact Mass 274.156895 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4MzOLt9mFEC
Name Ethyl (Z)-3-methyl-3-[4'-(4"-oxopentyl)phenyl]prop-2-enoate
Alternate Name(s) Ethyl (2E)-3-[2-(4-oxopentyl)phenyl]-2-butenoate Ethyl (Z)-3-methyl-3-[4'-(2''-oxophenyl)phenyl]prop-2-enoate Ethyl (Z)-3-methyl-3-[4'-(2''-oxophenyl)phenyl]prop-2-enoate Ethyl (Z)-3-methyl-3-[4'-(4''-oxopentyl)phenyl]prop-2-enoate
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Formula C17H22O3
InChI InChI=1S/C17H22O3/c1-4-20-17(19)12-13(2)16-11-6-5-9-15(16)10-7-8-14(3)18/h5-6,9,11-12H,4,7-8,10H2,1-3H3/b13-12+
InChIKey UMSGNAQMXRMGAW-OUKQBFOZSA-N
Molecular Weight 274.360 g/mol
SMILES C(\C=C\(c1c(CCCC(=O)C)cccc1)C)(=O)OCC
SPLASH splash10-002f-0920000000-46b6f1060e97633547fe
Source of Spectrum H-82-594-0
Wiley ID 815287