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2H-Pyran-4-acetic acid, 6-ethyl-5-(methoxycarbonyl)-2-oxo-, methyl ester
SpectraBase Compound ID I1PN9BtVzFY
InChI InChI=1S/C12H14O6/c1-4-8-11(12(15)17-3)7(5-9(13)16-2)6-10(14)18-8/h6H,4-5H2,1-3H3
InChIKey ZAVFXANJIRQVBZ-UHFFFAOYSA-N
Mol Weight 254.24 g/mol
Molecular Formula C12H14O6
Exact Mass 254.079038 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5sB7n9LtSAp
Name 2H-Pyran-4-acetic acid, 6-ethyl-5-(methoxycarbonyl)-2-oxo-, methyl ester
Alternate Name(s) Methyl 6-ethyl-4-(2-methoxy-2-oxoethyl)-2-oxo-2H-pyran-5-carboxylate Methyl 6-ethyl-5-(methoxycarbonyl)-2-oxo-2H-pyran-4-acetate
CAS Registry Number 107941-34-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H14O6
InChI InChI=1S/C12H14O6/c1-4-8-11(12(15)17-3)7(5-9(13)16-2)6-10(14)18-8/h6H,4-5H2,1-3H3
InChIKey ZAVFXANJIRQVBZ-UHFFFAOYSA-N
Molecular Weight 254.238 g/mol
SMILES C=1(C(=CC(OC1CC)=O)CC(=O)OC)C(=O)OC
SPLASH splash10-0603-5980000000-e88d4ff6e651fa641bf4
Source of Spectrum J-52-1899-42
Wiley ID 1257370