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(R*,R*)-N,N-Diisopropyl-2-{(2R*)-2-[benzyl(methy)amino]-2-phenylethyl}-6-{(2S*)-2-[benzyl(methyl)amino]-2-phenylethyl}-4-methylbenzamide
SpectraBase Compound ID 5EKkkZdQDQG
InChI InChI=1S/C46H55N3O/c1-34(2)49(35(3)4)46(50)45-41(30-43(39-24-16-10-17-25-39)47(6)32-37-20-12-8-13-21-37)28-36(5)29-42(45)31-44(40-26-18-11-19-27-40)48(7)33-38-22-14-9-15-23-38/h8-29,34-35,43-44H,30-33H2,1-7H3/t43-,44+
InChIKey QTLKSBDDPYGFDB-PIYFIQLCSA-N
Mol Weight 666.0 g/mol
Molecular Formula C46H55N3O
Exact Mass 665.434513 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8ofWiDerYmn
Name (R*,R*)-N,N-Diisopropyl-2-{(2R*)-2-[benzyl(methy)amino]-2-phenylethyl}-6-{(2S*)-2-[benzyl(methyl)amino]-2-phenylethyl}-4-methylbenzamide
Comments Less than 3 mono-isotopic peaks
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Formula C46H55N3O
InChI InChI=1S/C46H55N3O/c1-34(2)49(35(3)4)46(50)45-41(30-43(39-24-16-10-17-25-39)47(6)32-37-20-12-8-13-21-37)28-36(5)29-42(45)31-44(40-26-18-11-19-27-40)48(7)33-38-22-14-9-15-23-38/h8-29,34-35,43-44H,30-33H2,1-7H3/t43-,44+
InChIKey QTLKSBDDPYGFDB-PIYFIQLCSA-N
Molecular Weight 665.966 g/mol
SMILES C(c1c(C[C@@](N(Cc2ccccc2)C)(c2ccccc2)[H])cc(cc1C[C@](N(Cc1ccccc1)C)(c1ccccc1)[H])C)(N(C(C)C)C(C)C)=O
SPLASH splash10-03di-0090000000-7ee4e4e12e41053d8620
Source of Spectrum K-2002-915-45
Synonyms 4-methyl-6-[(2R)-2-[methyl-(phenylmethyl)amino]-2-phenylethyl]-2-[(2S)-2-[methyl-(phenylmethyl)amino]-2-phenylethyl]-N,N-di(propan-2-yl)benzamide 6-[(2R)-2-[benzyl(methyl)amino]-2-phenylethyl]-2-[(2S)-2-[benzyl(methyl)amino]-2-phenylethyl]-4-methyl-N,N-di(propan-2-yl)benzamide 4-methyl-6-[(2R)-2-[methyl-(phenylmethyl)amino]-2-phenyl-ethyl]-2-[(2S)-2-[methyl-(phenylmethyl)amino]-2-phenyl-ethyl]-N,N-di(propan-2-yl)benzamide
Wiley ID 1581158