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Phosphonic Acid, [5-(2-methyl-1,3-dioxolam-2-yl)-2-oxocyclohexyl]-,diethyl ester trans
SpectraBase Compound ID JhTnEzdMNyw
InChI InChI=1S/C14H25O6P/c1-4-19-21(16,20-5-2)13-10-11(6-7-12(13)15)14(3)17-8-9-18-14/h11,13H,4-10H2,1-3H3/t11-,13+/m0/s1
InChIKey QVLZKGGVUGRFFU-WCQYABFASA-N
Mol Weight 320.32 g/mol
Molecular Formula C14H25O6P
Exact Mass 320.138876 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FsqxmGrzj1p
Name Phosphonic Acid, [5-(2-methyl-1,3-dioxolam-2-yl)-2-oxocyclohexyl]-,diethyl ester trans
CAS Registry Number 137626-96-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H25O6P
InChI InChI=1S/C14H25O6P/c1-4-19-21(16,20-5-2)13-10-11(6-7-12(13)15)14(3)17-8-9-18-14/h11,13H,4-10H2,1-3H3/t11-,13+/m0/s1
InChIKey QVLZKGGVUGRFFU-WCQYABFASA-N
Molecular Weight 320.322 g/mol
SMILES [C@]1(P(=O)(OCC)OCC)(C[C@@](C2(OCCO2)C)(CCC1=O)[H])[H]
SPLASH splash10-000i-9000000000-f40e9db38295cf5c0631
Source of Spectrum J-57-319-5
Synonyms Diethyl (1R,5S)-5-(2-methyl-1,3-dioxolan-2-yl)-2-oxocyclohexylphosphonate [(1R,5S)-5-(2-Methyl-[1,3]dioxolan-2-yl)-2-oxo-cyclohexyl]-phosphonic acid diethyl ester
Wiley ID 1319790