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Ethyl 6-(but-3-enyl)-2-oxo-4-phenyl-2H-pyran-3-carboxylate
SpectraBase Compound ID 9AAmNXGrGC6
InChI InChI=1S/C18H18O4/c1-3-5-11-14-12-15(13-9-7-6-8-10-13)16(18(20)22-14)17(19)21-4-2/h3,6-10,12H,1,4-5,11H2,2H3
InChIKey ZSOHQHVFCHQBAF-UHFFFAOYSA-N
Mol Weight 298.34 g/mol
Molecular Formula C18H18O4
Exact Mass 298.120509 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5C9hh1sQTYm
Name Ethyl 6-(but-3-enyl)-2-oxo-4-phenyl-2H-pyran-3-carboxylate
Alternate Name(s) Ethyl 6-(but-3-en-1-yl)-2-oxo-4-phenyl-2H-pyran-3-carboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H18O4
InChI InChI=1S/C18H18O4/c1-3-5-11-14-12-15(13-9-7-6-8-10-13)16(18(20)22-14)17(19)21-4-2/h3,6-10,12H,1,4-5,11H2,2H3
InChIKey ZSOHQHVFCHQBAF-UHFFFAOYSA-N
Literature Reference DOI 10.1039/c3cc46788k
Molecular Weight 298.338 g/mol
SMILES C=1(OC(C(C(OCC)=O)=C(C1)c1ccccc1)=O)CCC=C
SPLASH splash10-05r0-1490000000-a6d7b3344280304b4107
Source of Spectrum KD-50-542/SM-8i
Wiley ID 1754214