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(2S)-2-methyl-4-oxo-3H-pyran-2-carboxylic acid ethyl ester
SpectraBase Compound ID 9ieWz4aZtnn
InChI InChI=1S/C9H12O4/c1-3-12-8(11)9(2)6-7(10)4-5-13-9/h4-5H,3,6H2,1-2H3/t9-/m0/s1
InChIKey NHLRCCGSQOIUOW-VIFPVBQESA-N
Mol Weight 184.19 g/mol
Molecular Formula C9H12O4
Exact Mass 184.073559 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KoAQBhZjVbF
Name (2S)-2-methyl-4-oxo-3H-pyran-2-carboxylic acid ethyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H12O4
InChI InChI=1S/C9H12O4/c1-3-12-8(11)9(2)6-7(10)4-5-13-9/h4-5H,3,6H2,1-2H3/t9-/m0/s1
InChIKey NHLRCCGSQOIUOW-VIFPVBQESA-N
Molecular Weight 184.191 g/mol
SMILES [C@]1(C(=O)OCC)(CC(=O)C=CO1)C
SPLASH splash10-03di-0900000000-4d5f583f32aa51fb993f
Source of Spectrum KD-15-1992-4
Synonyms (2S)-4-keto-2-methyl-3H-pyran-2-carboxylic acid ethyl ester Ethyl (2S)-2-methyl-4-oxidanylidene-3H-pyran-2-carboxylate Ethyl (2S)-2-methyl-4-oxo-3H-pyran-2-carboxylate
Wiley ID 1637124