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2,2-Diethyl-4-methyl-6-oxo-3H-pyran-3-carboxylic acid methyl ester
SpectraBase Compound ID FeooKyxG7my
InChI InChI=1S/C12H18O4/c1-5-12(6-2)10(11(14)15-4)8(3)7-9(13)16-12/h7,10H,5-6H2,1-4H3
InChIKey DYYQNFFPGDTVBV-UHFFFAOYSA-N
Mol Weight 226.27 g/mol
Molecular Formula C12H18O4
Exact Mass 226.120509 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ElThf22pDnw
Name 2,2-Diethyl-4-methyl-6-oxo-3H-pyran-3-carboxylic acid methyl ester
CAS Registry Number 115754-72-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H18O4
InChI InChI=1S/C12H18O4/c1-5-12(6-2)10(11(14)15-4)8(3)7-9(13)16-12/h7,10H,5-6H2,1-4H3
InChIKey DYYQNFFPGDTVBV-UHFFFAOYSA-N
Molecular Weight 226.272 g/mol
SMILES C1(C(OC(C=C1C)=O)(CC)CC)C(=O)OC
SPLASH splash10-05mo-0900000000-d9cdf3191a09ae7ecfed
Source of Spectrum O-22-802-1
Synonyms 2,2-Diethyl-6-keto-4-methyl-3H-pyran-3-carboxylic acid methyl ester Methyl 2,2-diethyl-4-methyl-6-oxidanylidene-3H-pyran-3-carboxylate Methyl 2,2-diethyl-4-methyl-6-oxo-3H-pyran-3-carboxylate
Wiley ID 1227322