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(trans)-Octahydro-.alpha.-(4'-nitrophenyl)-1,3-dimethyl-2H-1,3,2-benzodiazaphosphole-2-methanol - 2-oxide
SpectraBase Compound ID 5bhKv1YATX
InChI InChI=1S/C15H22N3O4P/c1-16-13-5-3-4-6-14(13)17(2)23(16,22)15(19)11-7-9-12(10-8-11)18(20)21/h7-10,13-15,19H,3-6H2,1-2H3/t13-,14-,15?/m1/s1
InChIKey BWGQIQBAOXNIMU-GRKKQISMSA-N
Mol Weight 339.33 g/mol
Molecular Formula C15H22N3O4P
Exact Mass 339.134793 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID L8d7ncxT8q3
Name (trans)-Octahydro-.alpha.-(4'-nitrophenyl)-1,3-dimethyl-2H-1,3,2-benzodiazaphosphole-2-methanol - 2-oxide
Alternate Name(s) [(3aR,7aR)-1,3-dimethyl-2-oxidooctahydro-1H-1,3,2-benzodiazaphosphol-2-yl](4-nitrophenyl)methanol
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Formula C15H22N3O4P
InChI InChI=1S/C15H22N3O4P/c1-16-13-5-3-4-6-14(13)17(2)23(16,22)15(19)11-7-9-12(10-8-11)18(20)21/h7-10,13-15,19H,3-6H2,1-2H3/t13-,14-,15?/m1/s1
InChIKey BWGQIQBAOXNIMU-GRKKQISMSA-N
Molecular Weight 339.332 g/mol
SMILES OC(P1(N([C@@]2(CCCC[C@]2(N1C)[H])[H])C)=O)c1ccc(N(=O)=O)cc1
SPLASH splash10-0f79-0921000000-f9eda448c10c5b668e3d
Source of Spectrum H-82-1498-14
Wiley ID 815577