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Methyl (3S/R,4S)-3-(2,2-Dimethyl-5-oxo-1,3-dioxane-4-yl)butanoate
SpectraBase Compound ID 9vXBOGeIDPy
InChI InChI=1S/C11H18O5/c1-7(5-9(13)14-4)10-8(12)6-15-11(2,3)16-10/h7,10H,5-6H2,1-4H3/t7?,10-/m0/s1
InChIKey CCJOJZNBPAYWCN-MHPPCMCBSA-N
Mol Weight 230.26 g/mol
Molecular Formula C11H18O5
Exact Mass 230.115424 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1F1HChmPiNf
Name Methyl (3S/R,4S)-3-(2,2-Dimethyl-5-oxo-1,3-dioxane-4-yl)butanoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H18O5
InChI InChI=1S/C11H18O5/c1-7(5-9(13)14-4)10-8(12)6-15-11(2,3)16-10/h7,10H,5-6H2,1-4H3/t7?,10-/m0/s1
InChIKey CCJOJZNBPAYWCN-MHPPCMCBSA-N
Molecular Weight 230.260 g/mol
SMILES [C@@]1(OC(C)(C)OCC1=O)(C(CC(=O)OC)C)[H]
SPLASH splash10-00di-8900000000-8763a5291b6d2e2e3048
Source of Spectrum SO-0-651-5
Wiley ID 874513