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(2R,3R)-1-Benzhydryl-3-p-tolyl-aziridine-2-carboxylic acid ethyl ester
SpectraBase Compound ID 5VxSvR7mJrc
InChI InChI=1S/C25H25NO2/c1-3-28-25(27)24-23(21-16-14-18(2)15-17-21)26(24)22(19-10-6-4-7-11-19)20-12-8-5-9-13-20/h4-17,22-24H,3H2,1-2H3/t23-,24-,26?/m1/s1
InChIKey CKICLSQQDXFDCI-LBHOTPKDSA-N
Mol Weight 371.48 g/mol
Molecular Formula C25H25NO2
Exact Mass 371.188529 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DrSSwZBBcj9
Name (2R,3R)-1-Benzhydryl-3-p-tolyl-aziridine-2-carboxylic acid ethyl ester
Alternate Name(s) Ethyl 1-(benzhydryl)-3-(4'-tolyl)aziridine-2-carboxylate
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Formula C25H25NO2
InChI InChI=1S/C25H25NO2/c1-3-28-25(27)24-23(21-16-14-18(2)15-17-21)26(24)22(19-10-6-4-7-11-19)20-12-8-5-9-13-20/h4-17,22-24H,3H2,1-2H3/t23-,24-,26?/m1/s1
InChIKey CKICLSQQDXFDCI-LBHOTPKDSA-N
Molecular Weight 371.480 g/mol
SMILES [C@@]1(N([C@@]1(c1ccc(cc1)C)[H])C(c1ccccc1)c1ccccc1)(C(=O)OCC)[H]
SPLASH splash10-0fai-0940000000-353407a753808894efd7
Source of Spectrum QE-14-3797-10d
Wiley ID 1692054