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(2R,3R)-1-Benzhydryl-3-(4-nitro-phenyl)-aziridine-2-carboxylic acid ethyl ester
SpectraBase Compound ID GkNqxAKXrsh
InChI InChI=1S/C24H22N2O4/c1-2-30-24(27)23-22(19-13-15-20(16-14-19)26(28)29)25(23)21(17-9-5-3-6-10-17)18-11-7-4-8-12-18/h3-16,21-23H,2H2,1H3/t22-,23-,25?/m1/s1
InChIKey BCWMCWDSOSLQFX-PSJAQFSKSA-N
Mol Weight 402.45 g/mol
Molecular Formula C24H22N2O4
Exact Mass 402.157957 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KzXBO2Oi0b
Name (2R,3R)-1-Benzhydryl-3-(4-nitro-phenyl)-aziridine-2-carboxylic acid ethyl ester
Alternate Name(s) Ethyl 1-(benzhydryl)-3-(4'-nitrophenyl)aziridine-2-carboxylate
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Formula C24H22N2O4
InChI InChI=1S/C24H22N2O4/c1-2-30-24(27)23-22(19-13-15-20(16-14-19)26(28)29)25(23)21(17-9-5-3-6-10-17)18-11-7-4-8-12-18/h3-16,21-23H,2H2,1H3/t22-,23-,25?/m1/s1
InChIKey BCWMCWDSOSLQFX-PSJAQFSKSA-N
Molecular Weight 402.450 g/mol
SMILES [C@@]1(N([C@@]1(c1ccc(N(=O)=O)cc1)[H])C(c1ccccc1)c1ccccc1)(C(=O)OCC)[H]
SPLASH splash10-014i-0900000000-3555bc21db3abac836c8
Source of Spectrum QE-14-3798-10g
Wiley ID 1692051