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[3-((S)-4'a-Methyl-5'-oxo-3',4',4'a,5',6',7'-hexahydro-1'H-spiro[[1,3]dioxolane-2,2'-naphthalen]-6'-yl)-prop-1-ynyl]-phosphonic acid diethyl ester

View entire compound with spectra: 1 MS (GC)

[3-((S)-4'a-Methyl-5'-oxo-3',4',4'a,5',6',7'-hexahydro-1'H-spiro[[1,3]dioxolane-2,2'-naphthalen]-6'-yl)-prop-1-ynyl]-phosphonic acid diethyl ester
SpectraBase Compound ID L0aTN0sPpE6
InChI InChI=1S/C20H29O6P/c1-4-25-27(22,26-5-2)14-6-7-16-8-9-17-15-20(23-12-13-24-20)11-10-19(17,3)18(16)21/h9,16H,4-5,7-8,10-13,15H2,1-3H3/t16?,19-/m0/s1
InChIKey RYKUQIFKPXYZQI-CVMIBEPCSA-N
Mol Weight 396.42 g/mol
Molecular Formula C20H29O6P
Exact Mass 396.170176 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BAU87ecfWzJ
Name [3-((S)-4'a-Methyl-5'-oxo-3',4',4'a,5',6',7'-hexahydro-1'H-spiro[[1,3]dioxolane-2,2'-naphthalen]-6'-yl)-prop-1-ynyl]-phosphonic acid diethyl ester
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Formula C20H29O6P
InChI InChI=1S/C20H29O6P/c1-4-25-27(22,26-5-2)14-6-7-16-8-9-17-15-20(23-12-13-24-20)11-10-19(17,3)18(16)21/h9,16H,4-5,7-8,10-13,15H2,1-3H3/t16?,19-/m0/s1
InChIKey RYKUQIFKPXYZQI-CVMIBEPCSA-N
Molecular Weight 396.420 g/mol
SMILES [C@]12(C(=CCC(C2=O)CC#CP(=O)(OCC)OCC)CC2(CC1)OCCO2)C
SPLASH splash10-0002-9112000000-59e5052c98b8193dec91
Source of Spectrum KC-1992-1765-8
Synonyms (S)-Diethyl 3-(6,6-ethylenedioxy-8a-methyl-1-oxo-1,2,3,5,6,7,8,8a-octahydro-2-naphthyl)propyn-1-ynylphosphonate Diethyl 3-(6,6-ethylenedioxy-8a-methyl-1-oxo-1,2,3,5,6,7,8,8a-octahydro-2-naphthyl)propyn-1-ynylphosphonate Diethyl {3-[(4'aS)-4'a-methyl-5'-oxo-3',4',4'a,5',6',7'-hexahydro-1'H-spiro[1,3-dioxolane-2,2'-naphthalene]-6'-yl]prop-1-yn-1-yl}phosphonate
Wiley ID 776650