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(3aR,14bR)-1,3-dibenzyl-9-morpholino-1,3,3a,14b-tetrahydro-2H-dibenzo[4,5:8,9][1,3,2]dioxaphosphonino[6,7-d]imidazol-2-one
SpectraBase Compound ID 4UjUhGH2sPJ
InChI InChI=1S/C33H32N3O4P/c37-33-35(23-25-11-3-1-4-12-25)31-27-15-7-9-17-29(27)39-41(34-19-21-38-22-20-34)40-30-18-10-8-16-28(30)32(31)36(33)24-26-13-5-2-6-14-26/h1-18,31-32H,19-24H2/t31-,32-/m1/s1
InChIKey FREXGWMOFZSYIH-ROJLCIKYSA-N
Mol Weight 565.6 g/mol
Molecular Formula C33H32N3O4P
Exact Mass 565.213044 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1fE01Rp4zo
Name (3aR,14bR)-1,3-dibenzyl-9-morpholino-1,3,3a,14b-tetrahydro-2H-dibenzo[4,5:8,9][1,3,2]dioxaphosphonino[6,7-d]imidazol-2-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C33H32N3O4P
InChI InChI=1S/C33H32N3O4P/c37-33-35(23-25-11-3-1-4-12-25)31-27-15-7-9-17-29(27)39-41(34-19-21-38-22-20-34)40-30-18-10-8-16-28(30)32(31)36(33)24-26-13-5-2-6-14-26/h1-18,31-32H,19-24H2/t31-,32-/m1/s1
InChIKey FREXGWMOFZSYIH-ROJLCIKYSA-N
Literature Reference DOI 10.1002/anie.201104912
Molecular Weight 565.610 g/mol
SMILES c12OP(Oc3c([C@@]4([C@@](c1cccc2)(N(C(N4Cc1ccccc1)=O)Cc1ccccc1)[H])[H])cccc3)N1CCOCC1
SPLASH splash10-014l-9300000000-54248a8bdccedd09274c
Source of Spectrum ACI-50-SM2-(R,R)_L5
Wiley ID 1780095