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2-Cyclopropene-1-carboxylic acid, 1-(3-ethoxy-3-oxo-1-propenyl)-2-phenyl-, ethyl ester
SpectraBase Compound ID 7GpJUUUmkzW
InChI InChI=1S/C17H18O4/c1-3-20-15(18)10-11-17(16(19)21-4-2)12-14(17)13-8-6-5-7-9-13/h5-12H,3-4H2,1-2H3/b11-10+
InChIKey KSPJKYGNOKVXDC-ZHACJKMWSA-N
Mol Weight 286.33 g/mol
Molecular Formula C17H18O4
Exact Mass 286.120509 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9ecjPzstqSB
Name 2-Cyclopropene-1-carboxylic acid, 1-(3-ethoxy-3-oxo-1-propenyl)-2-phenyl-, ethyl ester
CAS Registry Number 116441-74-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H18O4
InChI InChI=1S/C17H18O4/c1-3-20-15(18)10-11-17(16(19)21-4-2)12-14(17)13-8-6-5-7-9-13/h5-12H,3-4H2,1-2H3/b11-10+
InChIKey KSPJKYGNOKVXDC-ZHACJKMWSA-N
Molecular Weight 286.327 g/mol
SMILES C1(C(c2ccccc2)=C1)(\C=C\C(=O)OCC)C(=O)OCC
SPLASH splash10-0a6r-2490000000-73030347fba2192ecaa2
Source of Spectrum F-44-3347-3
Synonyms Ethyl 1-[(1E)-3-ethoxy-3-oxo-1-propenyl]-2-phenyl-2-cyclopropene-1-carboxylate Ethyl 3-(1-ethoxycarbonyl-2-phenyl-2-cyclopropen-1-yl)-2-propenoate
Wiley ID 1290000