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(2S,4S)-4-methyl-5-oxo-2-oxolanecarboxylic acid ethyl ester
SpectraBase Compound ID 5dAapVWeh8Y
InChI InChI=1S/C8H12O4/c1-3-11-8(10)6-4-5(2)7(9)12-6/h5-6H,3-4H2,1-2H3/t5-,6-/m0/s1
InChIKey KFTWUTYDSWYGDJ-WDSKDSINSA-N
Mol Weight 172.18 g/mol
Molecular Formula C8H12O4
Exact Mass 172.073559 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3732OU3n7Zf
Name (2S,4S)-4-methyl-5-oxo-2-oxolanecarboxylic acid ethyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H12O4
InChI InChI=1S/C8H12O4/c1-3-11-8(10)6-4-5(2)7(9)12-6/h5-6H,3-4H2,1-2H3/t5-,6-/m0/s1
InChIKey KFTWUTYDSWYGDJ-WDSKDSINSA-N
Molecular Weight 172.180 g/mol
SMILES C1(O[C@@](C[C@@]1(C)[H])(C(=O)OCC)[H])=O
SPLASH splash10-0002-9000000000-97c342b4ce38ec45ee0d
Source of Spectrum QC-11-1363-10
Synonyms (2S,4S)-5-keto-4-methyl-tetrahydrofuran-2-carboxylic acid ethyl ester Ethyl (2S,4S)-4-methyl-5-oxidanylidene-oxolane-2-carboxylate Ethyl (2S,4S)-4-methyl-5-oxo-tetrahydrofuran-2-carboxylate Ethyl (2S,4S)-4-methyl-5-oxooxolane-2-carboxylate
Wiley ID 859803