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(rel-6R,12bR)-Diphenyl(6-phenyl-3,4,6,13b-tetrahydro-1H-[1,3]dioxolo[4',5':4,5]benzo[c][1,4]oxazino[4,3-a]azepin-8-yl)phosphanoxide
SpectraBase Compound ID BoDUWqRLWTk
InChI InChI=1S/C32H28NO4P/c34-38(24-12-6-2-7-13-24,25-14-8-3-9-15-25)32-20-28(23-10-4-1-5-11-23)33-16-17-35-21-29(33)26-18-30-31(19-27(26)32)37-22-36-30/h1-15,18-20,28-29H,16-17,21-22H2/t28-,29+/m1/s1
InChIKey ALQXVIHHKABQAW-WDYNHAJCSA-N
Mol Weight 521.6 g/mol
Molecular Formula C32H28NO4P
Exact Mass 521.175595 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID K98J7eMhSFr
Name (rel-6R,12bR)-Diphenyl(6-phenyl-3,4,6,13b-tetrahydro-1H-[1,3]dioxolo[4',5':4,5]benzo[c][1,4]oxazino[4,3-a]azepin-8-yl)phosphanoxide
Alternate Name(s) (6R,13bR)-6-phenyl-3,4,6,13b-tetrahydro-1H-[1,3]dioxolo[4,5-h][1,4]oxazino[3,4-a][2]benzazepin-8-yl(diphenyl)phosphine oxide (6R,13bR)-8-(diphenylphosphoryl)-6-phenyl-3,4,6,13b-tetrahydro-1H-[1,3]dioxolo[4,5-h][1,4]oxazino[3,4-a][2]benzazepine
Comments Less than 3 mono-isotopic peaks
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Formula C32H28NO4P
InChI InChI=1S/C32H28NO4P/c34-38(24-12-6-2-7-13-24,25-14-8-3-9-15-25)32-20-28(23-10-4-1-5-11-23)33-16-17-35-21-29(33)26-18-30-31(19-27(26)32)37-22-36-30/h1-15,18-20,28-29H,16-17,21-22H2/t28-,29+/m1/s1
InChIKey ALQXVIHHKABQAW-WDYNHAJCSA-N
Molecular Weight 521.553 g/mol
SMILES C=1(c2c([C@@]3(COCCN3[C@](C1)(c1ccccc1)[H])[H])cc1c(c2)OCO1)P(=O)(c1ccccc1)c1ccccc1
SPLASH splash10-00di-0009010000-5b2c8dcb32a3c5bef40f
Source of Spectrum F-69-4922-7
Wiley ID 1595324