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1,1'-((11bS,12aR,16aR,17aS)-6-(dimethylamino)-12a,13,14,15,16,16a-hexahydrodibenzo[4,5:8,9][1,3,2]dioxaphosphonino[6,7-b]quinoxaline-12,17(11bH,17aH)-diyl)diethanone

View entire compound with spectra: 1 MS (GC)

1,1'-((11bS,12aR,16aR,17aS)-6-(dimethylamino)-12a,13,14,15,16,16a-hexahydrodibenzo[4,5:8,9][1,3,2]dioxaphosphonino[6,7-b]quinoxaline-12,17(11bH,17aH)-diyl)diethanone
SpectraBase Compound ID 3dksjV8QS1a
InChI InChI=1S/C26H32N3O4P/c1-17(30)28-21-13-7-8-14-22(21)29(18(2)31)26-20-12-6-10-16-24(20)33-34(27(3)4)32-23-15-9-5-11-19(23)25(26)28/h5-6,9-12,15-16,21-22,25-26H,7-8,13-14H2,1-4H3/t21-,22-,25+,26+/m1/s1
InChIKey DQQULGFGQJCKRR-PWGHIRGTSA-N
Mol Weight 481.5 g/mol
Molecular Formula C26H32N3O4P
Exact Mass 481.213044 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DLVXt9vO2jn
Name 1,1'-((11bS,12aR,16aR,17aS)-6-(dimethylamino)-12a,13,14,15,16,16a-hexahydrodibenzo[4,5:8,9][1,3,2]dioxaphosphonino[6,7-b]quinoxaline-12,17(11bH,17aH)-diyl)diethanone
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Formula C26H32N3O4P
InChI InChI=1S/C26H32N3O4P/c1-17(30)28-21-13-7-8-14-22(21)29(18(2)31)26-20-12-6-10-16-24(20)33-34(27(3)4)32-23-15-9-5-11-19(23)25(26)28/h5-6,9-12,15-16,21-22,25-26H,7-8,13-14H2,1-4H3/t21-,22-,25+,26+/m1/s1
InChIKey DQQULGFGQJCKRR-PWGHIRGTSA-N
Molecular Weight 481.533 g/mol
SMILES C1CC[C@]2(N([C@@]3([C@@](N(C(=O)C)[C@]2([H])C1)(c1c(cccc1)OP(Oc1ccccc31)N(C)C)[H])[H])C(C)=O)[H]
SPLASH splash10-014i-0900100000-2a6fa3ad8d2c835eaca6
Source of Spectrum ASC-348-1049/SM4-(2S,3S,5R,6R)_4a
Wiley ID 1765246