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(2S,3S)-tert-butyl-2-(diphenylmethyleneamino)-3-(1H-indol-3-yl)-3-(4-nitrophenyl)propanoate
SpectraBase Compound ID B296Z6nBJAZ
InChI InChI=1S/C34H31N3O4/c1-34(2,3)41-33(38)32(36-31(24-12-6-4-7-13-24)25-14-8-5-9-15-25)30(23-18-20-26(21-19-23)37(39)40)28-22-35-29-17-11-10-16-27(28)29/h4-22,30,32,35H,1-3H3/t30-,32-/m0/s1
InChIKey NASNZHDGVGMOPL-CDZUIXILSA-N
Mol Weight 545.6 g/mol
Molecular Formula C34H31N3O4
Exact Mass 545.231456 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CQzIliFZqez
Name (2S,3S)-tert-butyl-2-(diphenylmethyleneamino)-3-(1H-indol-3-yl)-3-(4-nitrophenyl)propanoate
Alternate Name(s) (2S,3S)-tert-butyl 2-((diphenylmethylene)amino)-3-(1H-indol-3-yl)-3-(4-nitrophenyl)propanoate (2S,3S)-2-[(diphenylmethylene)amino]-3-(1H-indol-3-yl)-3-(4-nitrophenyl)propanoic acid tert-butyl ester tert-Butyl (2S,3S)-2-(benzhydrylideneamino)-3-(1H-indol-3-yl)-3-(4-nitrophenyl)propanoate tert-Butyl (2S,3S)-2-[(diphenylmethylidene)amino]-3-(1H-indol-3-yl)-3-(4-nitrophenyl)propanoate
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Formula C34H31N3O4
InChI InChI=1S/C34H31N3O4/c1-34(2,3)41-33(38)32(36-31(24-12-6-4-7-13-24)25-14-8-5-9-15-25)30(23-18-20-26(21-19-23)37(39)40)28-22-35-29-17-11-10-16-27(28)29/h4-22,30,32,35H,1-3H3/t30-,32-/m0/s1
InChIKey NASNZHDGVGMOPL-CDZUIXILSA-N
Literature Reference DOI 10.1021/ol100161n
Molecular Weight 545.639 g/mol
SMILES [nH]1cc(c2c1cccc2)[C@@]([C@@](C(OC(C)(C)C)=O)(N=C(c1ccccc1)c1ccccc1)[H])(c1ccc(cc1)[N+](=O)[O-])[H]
SPLASH splash10-052o-9330000000-ca686722c16c025a661d
Source of Spectrum A1-12-1688/SMS6-3eb
Wiley ID 1751946