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Ethyl (E)-2-methyl-3-phenylethynyl-2-butenoate
SpectraBase Compound ID 4l320mD9J5T
InChI InChI=1S/C15H16O2/c1-4-17-15(16)13(3)12(2)10-11-14-8-6-5-7-9-14/h5-9H,4H2,1-3H3/b13-12+
InChIKey ZKHCQDKPGFDJRO-OUKQBFOZSA-N
Mol Weight 228.29 g/mol
Molecular Formula C15H16O2
Exact Mass 228.11503 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CeQoRyqkVtV
Name Ethyl (E)-2-methyl-3-phenylethynyl-2-butenoate
Alternate Name(s) Ethyl (2E)-2,3-dimethyl-5-phenyl-2-penten-4-ynoate (E)-2,3-dimethyl-5-phenylpent-2-en-4-ynoic acid ethyl ester Ethyl (E)-2,3-dimethyl-5-phenylpent-2-en-4-ynoate Ethyl (E)-2,3-dimethyl-5-phenyl-pent-2-en-4-ynoate
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Formula C15H16O2
InChI InChI=1S/C15H16O2/c1-4-17-15(16)13(3)12(2)10-11-14-8-6-5-7-9-14/h5-9H,4H2,1-3H3/b13-12+
InChIKey ZKHCQDKPGFDJRO-OUKQBFOZSA-N
Molecular Weight 228.291 g/mol
SMILES C(#Cc1ccccc1)\C(=C\(C(=O)OCC)C)C
SPLASH splash10-0fwc-0920000000-205e1259f5175c8b6841
Source of Spectrum F-55-2110-17
Wiley ID 836798