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

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2-(1'-Hydroxy-(E)-but-2'-enyl)-2,3,3a,4,5,6,7,7a-octahydro-1,3-bis(2,2-dimethylpropyl)-1H-1,3,2-benzodiazaphosphole 2-Oxide
SpectraBase Compound ID DpJP67xzZmu
InChI InChI=1S/C20H39N2O2P/c1-8-11-18(23)25(24)21(14-19(2,3)4)16-12-9-10-13-17(16)22(25)15-20(5,6)7/h8,11,16-18,23H,9-10,12-15H2,1-7H3/b11-8+/t16-,17-,18?/m1/s1
InChIKey PHPYAVASCCEFIK-XQCAQCSWSA-N
Mol Weight 370.5 g/mol
Molecular Formula C20H39N2O2P
Exact Mass 370.274915 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID COKjjMBdCv5
Name 2-(1'-Hydroxy-(E)-but-2'-enyl)-2,3,3a,4,5,6,7,7a-octahydro-1,3-bis(2,2-dimethylpropyl)-1H-1,3,2-benzodiazaphosphole 2-Oxide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H39N2O2P
InChI InChI=1S/C20H39N2O2P/c1-8-11-18(23)25(24)21(14-19(2,3)4)16-12-9-10-13-17(16)22(25)15-20(5,6)7/h8,11,16-18,23H,9-10,12-15H2,1-7H3/b11-8+/t16-,17-,18?/m1/s1
InChIKey PHPYAVASCCEFIK-XQCAQCSWSA-N
Molecular Weight 370.518 g/mol
SMILES OC(P1(N([C@@]2(CCCC[C@]2(N1CC(C)(C)C)[H])[H])CC(C)(C)C)=O)\C=C\C
SPLASH splash10-0002-1093000000-fdc6cedbec987d922cfb
Source of Spectrum J-60-938-3
Synonyms (2E)-1-(1,3-dineopentyl-2-oxidooctahydro-1H-1,3,2-benzodiazaphosphol-2-yl)-2-buten-1-ol (E)-1-[(3aR,7aR)-1,3-Bis-(2,2-dimethyl-propyl)-2-oxo-octahydro-2.lambda.5-benzo[1,3,2]diazaphosphol-2-yl]-but-2-en-1-ol (E)-1-[(3aR,7aR)-1,3-bis(2,2-dimethylpropyl)-2-oxo-3a,4,5,6,7,7a-hexahydrobenzo[d][1,3,2]diazaphosphol-2-yl]-2-buten-1-ol (E)-1-[(3aR,7aR)-1,3-bis(2,2-dimethylpropyl)-2-oxo-3a,4,5,6,7,7a-hexahydrobenzo[d][1,3,2]diazaphosphol-2-yl]but-2-en-1-ol (E)-1-[(3aR,7aR)-1,3-bis(2,2-dimethylpropyl)-2-oxidanylidene-3a,4,5,6,7,7a-hexahydrobenzo[d][1,3,2]diazaphosphol-2-yl]but-2-en-1-ol
Wiley ID 1354280