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2H-Pyran-2-acetic acid, tetrahydro-.alpha.-hydroxy-2-methoxy-5,6-dimethyl-4-methylene-, methyl ester, [2.alpha.,2(S*),5.beta.,6.beta.]-(.+-.)-
SpectraBase Compound ID 7bRVS3clUlG
InChI InChI=1S/C12H20O5/c1-7-6-12(16-5,10(13)11(14)15-4)17-9(3)8(7)2/h8-10,13H,1,6H2,2-5H3/t8-,9-,10-,12-/m0/s1
InChIKey DXIWGAMPYCNDPD-GMOBBJLQSA-N
Mol Weight 244.29 g/mol
Molecular Formula C12H20O5
Exact Mass 244.131074 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1jTfWSjMlk
Name 2H-Pyran-2-acetic acid, tetrahydro-.alpha.-hydroxy-2-methoxy-5,6-dimethyl-4-methylene-, methyl ester, [2.alpha.,2(S*),5.beta.,6.beta.]-(.+-.)-
Alternate Name(s) Methyl (.+-.)-Pederate Methyl (.alpha.R*,2S*,5S*,6S*)-tetrahydro-2-methoxy-5,6-dimethyl-4-methylen-2H-pyran-2-glycolate Methyl (2R)-2-hydroxy-2-[(2S,5S,6S)-2-methoxy-5,6-dimethyl-4-methylideneoxan-2-yl]acetate
CAS Registry Number 62848-63-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H20O5
InChI InChI=1S/C12H20O5/c1-7-6-12(16-5,10(13)11(14)15-4)17-9(3)8(7)2/h8-10,13H,1,6H2,2-5H3/t8-,9-,10-,12-/m0/s1
InChIKey DXIWGAMPYCNDPD-GMOBBJLQSA-N
Molecular Weight 244.287 g/mol
SMILES O[C@]([C@]1(O[C@@](C)([C@](C(C1)=C)(C)[H])[H])OC)(C(=O)OC)[H]
SPLASH splash10-0pc1-9710000000-5c32afc914f4499a7118
Source of Spectrum C-101-5369-0
Wiley ID 1246789