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(3R,4R,5R)-2-keto-3,4,5-trimethyl-tetrahydropyran-3-carboxylic acid methyl ester
SpectraBase Compound ID Gh3YfHekQxB
InChI InChI=1S/C10H16O4/c1-6-5-14-9(12)10(3,7(6)2)8(11)13-4/h6-7H,5H2,1-4H3/t6-,7+,10+/m0/s1
InChIKey XMDGEBYPRLDBPC-NYNCVSEMSA-N
Mol Weight 200.23 g/mol
Molecular Formula C10H16O4
Exact Mass 200.104859 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8vsvVcTVqxf
Name (3R,4R,5R)-2-keto-3,4,5-trimethyl-tetrahydropyran-3-carboxylic acid methyl ester
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H16O4
InChI InChI=1S/C10H16O4/c1-6-5-14-9(12)10(3,7(6)2)8(11)13-4/h6-7H,5H2,1-4H3/t6-,7+,10+/m0/s1
InChIKey XMDGEBYPRLDBPC-NYNCVSEMSA-N
Molecular Weight 200.234 g/mol
SMILES [C@@]1(C(OC[C@@]([C@]1(C)[H])(C)[H])=O)(C(=O)OC)C
SPLASH splash10-0a4l-9600000000-ea231f86882504bd9872
Source of Spectrum KC-1-2128-10
Synonyms (3R,4R,5R)-3,4,5-trimethyl-2-oxo-3-oxanecarboxylic acid methyl ester Methyl (3R,4R,5R)-3,4,5-trimethyl-2-oxidanylidene-oxane-3-carboxylate Methyl (3R,4R,5R)-3,4,5-trimethyl-2-oxo-tetrahydropyran-3-carboxylate Methyl (3R,4R,5R)-3,4,5-trimethyl-2-oxooxane-3-carboxylate
Wiley ID 825733