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Dimethyl [Cyclohexyl({1-[(4-fluorophenyl)selanyl]propan-2-yl}-amino)methyl]phosphonate
SpectraBase Compound ID CSVwPjMtvPO
InChI InChI=1S/C18H29FNO3PSe/c1-14(13-25-17-11-9-16(19)10-12-17)20-18(24(21,22-2)23-3)15-7-5-4-6-8-15/h9-12,14-15,18,20H,4-8,13H2,1-3H3
InChIKey FEYQYXHTSUCGGZ-UHFFFAOYSA-N
Mol Weight 436.38 g/mol
Molecular Formula C18H29FNO3PSe
Exact Mass 437.103431 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JmLWr1LROFH
Name Dimethyl [Cyclohexyl({1-[(4-fluorophenyl)selanyl]propan-2-yl}-amino)methyl]phosphonate
Appearance Yellow oil
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Exact Mass 437.103430956 u
Formula C18H29FNO3PSe
InChI InChI=1S/C18H29FNO3PSe/c1-14(13-25-17-11-9-16(19)10-12-17)20-18(24(21,22-2)23-3)15-7-5-4-6-8-15/h9-12,14-15,18,20H,4-8,13H2,1-3H3
InChIKey FEYQYXHTSUCGGZ-UHFFFAOYSA-N
Instrument Name Shimadzu GCMS
Ionization Type EI
Literature Reference DOI 10.1002/ejoc.201701565
Molecular Weight 436.378 g/mol
Quality 70
SMILES N(C(C1CCCCC1)P(OC)(=O)OC)C(C[Se]C1=CC=C(C=C1)F)C
SPLASH splash10-0006-3590000000-d760f4831894dd2d8124
Sample Comments dr = 55:45
Source of Spectrum K1-2018-636-4k (DOI: 10.1002/ejoc.201701565)
Wiley ID 1894435