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2-Ethenyl-2,6,6-trimethyl-4-oxo-3-oxanecarboxylic acid ethyl ester
SpectraBase Compound ID HqXreukwG1L
InChI InChI=1S/C13H20O4/c1-6-13(5)10(11(15)16-7-2)9(14)8-12(3,4)17-13/h6,10H,1,7-8H2,2-5H3
InChIKey XCCIGFSFGUOXSD-UHFFFAOYSA-N
Mol Weight 240.3 g/mol
Molecular Formula C13H20O4
Exact Mass 240.136159 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DxGaK6rLQ4E
Name 2-Ethenyl-2,6,6-trimethyl-4-oxo-3-oxanecarboxylic acid ethyl ester
CAS Registry Number 114838-40-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H20O4
InChI InChI=1S/C13H20O4/c1-6-13(5)10(11(15)16-7-2)9(14)8-12(3,4)17-13/h6,10H,1,7-8H2,2-5H3
InChIKey XCCIGFSFGUOXSD-UHFFFAOYSA-N
Molecular Weight 240.299 g/mol
SMILES C1(C(C(=O)CC(O1)(C)C)C(=O)OCC)(C=C)C
SPLASH splash10-00pi-6930000000-e49bb60cfab179f374e3
Source of Spectrum J-53-3621-11
Synonyms 4-keto-2,6,6-trimethyl-2-vinyl-tetrahydropyran-3-carboxylic acid ethyl ester Ethyl 2,6,6-trimethyl-4-oxo-2-vinyl-tetrahydropyran-3-carboxylate Ethyl 2-ethenyl-2,6,6-trimethyl-4-oxidanylidene-oxane-3-carboxylate Ethyl 2-ethenyl-2,6,6-trimethyl-4-oxooxane-3-carboxylate
Wiley ID 1242866