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6-Cyclohexyl-3-(A-methoxycarbonyl-A-phenylimino- methyl)-2-oxo-4,4-diphenyl-1-aza-4.lambda.5-phosphinine
SpectraBase Compound ID EDrvFvUiHre
InChI InChI=1S/C31H31N2O3P/c1-36-31(35)28(32-24-16-8-3-9-17-24)29-30(34)33-27(23-14-6-2-7-15-23)22-37(29,25-18-10-4-11-19-25)26-20-12-5-13-21-26/h3-5,8-13,16-23H,2,6-7,14-15H2,1H3,(H,33,34)/b32-28-
InChIKey GHPLHDLZRZYLKV-BLCKFSMSSA-N
Mol Weight 510.57 g/mol
Molecular Formula C31H31N2O3P
Exact Mass 510.20723 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID L0kR3j9wJa7
Name 1,4-Azaphosphorine-3-acetic acid, 6-cyclohexyl-1,2,4,4-tetrahydro-2-oxo-4,4-diphenyl-.alpha.-(phenylimino)-, methyl ester
CAS Registry Number 126574-27-4
Comments Less than 3 mono-isotopic peaks
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Formula C31H31N2O3P
InChI InChI=1S/C31H31N2O3P/c1-36-31(35)28(32-24-16-8-3-9-17-24)29-30(34)33-27(23-14-6-2-7-15-23)22-37(29,25-18-10-4-11-19-25)26-20-12-5-13-21-26/h3-5,8-13,16-23H,2,6-7,14-15H2,1H3,(H,33,34)/b32-28-
InChIKey GHPLHDLZRZYLKV-BLCKFSMSSA-N
Molecular Weight 510.574 g/mol
SMILES N1C(=CP(=C(C1=O)\C(=N\c1ccccc1)C(=O)OC)(c1ccccc1)c1ccccc1)C1CCCCC1
SPLASH splash10-0udi-0000910000-d56f82dadf8f75763bbb
Source of Spectrum KC-1989-2276-5
Synonyms 6-Cyclohexyl-3-(.alpha.-methoxycarbonyl-.alpha.-phenyliminomethyl)-2-oxo-4,4-diphenyl-1-aza-4.lambda.(5)-phosphine methyl (2E)-(6-cyclohexyl-2-oxo-4,4-diphenyl-1,2-dihydro-1,4lambda(5)-azaphosphorin-3-yl)(phenylimino)ethanoate
Wiley ID 1400573