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2-(1'-Hydroxy-3'-phenyl-(E)-prop-2'-enyl)-2,3,3a,4,5,6,7,7a-octahydro-1,3-bis(3-methylbutyl)-1H-1,3,2-benzodiazaphosphole 2-Oxide

View entire compound with spectra: 1 MS (GC)

2-(1'-Hydroxy-3'-phenyl-(E)-prop-2'-enyl)-2,3,3a,4,5,6,7,7a-octahydro-1,3-bis(3-methylbutyl)-1H-1,3,2-benzodiazaphosphole 2-Oxide
SpectraBase Compound ID JX8vicVCHrI
InChI InChI=1S/C25H41N2O2P/c1-20(2)16-18-26-23-12-8-9-13-24(23)27(19-17-21(3)4)30(26,29)25(28)15-14-22-10-6-5-7-11-22/h5-7,10-11,14-15,20-21,23-25,28H,8-9,12-13,16-19H2,1-4H3/b15-14+/t23-,24-,25?/m1/s1
InChIKey IMYUKVZJDJMZGM-CAVQELCDSA-N
Mol Weight 432.6 g/mol
Molecular Formula C25H41N2O2P
Exact Mass 432.290566 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7B1NAUR0oWt
Name 2-(1'-Hydroxy-3'-phenyl-(E)-prop-2'-enyl)-2,3,3a,4,5,6,7,7a-octahydro-1,3-bis(3-methylbutyl)-1H-1,3,2-benzodiazaphosphole 2-Oxide
Alternate Name(s) (2E)-1-(1,3-diisopentyl-2-oxidooctahydro-1H-1,3,2-benzodiazaphosphol-2-yl)-3-phenyl-2-propen-1-ol (3aR,7aR)-2-(1'-Hydroxy-3'-phenyl-(E)-prop-2'-enyl)-2,3,3a,4,5,6,7,7a-octahydro-1,3-bis(3-methylbutyl)-1H-1,3,2-benzodiazaphosphole 2-Oxide (E)-1-[(3aR,7aR)-1,3-bis(3-methylbutyl)-2-oxo-3a,4,5,6,7,7a-hexahydrobenzo[d][1,3,2]diazaphosphol-2-yl]-3-phenyl-2-propen-1-ol (E)-1-[(3aR,7aR)-1,3-bis(3-methylbutyl)-2-oxo-3a,4,5,6,7,7a-hexahydrobenzo[d][1,3,2]diazaphosphol-2-yl]-3-phenylprop-2-en-1-ol (E)-1-[(3aR,7aR)-1,3-diisopentyl-2-oxo-3a,4,5,6,7,7a-hexahydrobenzo[d][1,3,2]diazaphosphol-2-yl]-3-phenyl-prop-2-en-1-ol (E)-1-[(3aR,7aR)-1,3-bis(3-methylbutyl)-2-oxidanylidene-3a,4,5,6,7,7a-hexahydrobenzo[d][1,3,2]diazaphosphol-2-yl]-3-phenyl-prop-2-en-1-ol
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Formula C25H41N2O2P
InChI InChI=1S/C25H41N2O2P/c1-20(2)16-18-26-23-12-8-9-13-24(23)27(19-17-21(3)4)30(26,29)25(28)15-14-22-10-6-5-7-11-22/h5-7,10-11,14-15,20-21,23-25,28H,8-9,12-13,16-19H2,1-4H3/b15-14+/t23-,24-,25?/m1/s1
InChIKey IMYUKVZJDJMZGM-CAVQELCDSA-N
Molecular Weight 432.589 g/mol
SMILES OC(P1(N([C@@]2(CCCC[C@]2(N1CCC(C)C)[H])[H])CCC(C)C)=O)\C=C\c1ccccc1
SPLASH splash10-0007-3191000000-c9f3a1b5487a4eade35e
Source of Spectrum J-60-936-3
Wiley ID 1382376