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3-(4-Methylphenyl)-5-[rel-(2R,3S)-3-phenyl-1-phthalimidoaziridin-2-yl]-1,2,4-oxadiazole
SpectraBase Compound ID 2pxED7TQCPv
InChI InChI=1S/C25H18N4O3/c1-15-11-13-17(14-12-15)22-26-23(32-27-22)21-20(16-7-3-2-4-8-16)28(21)29-24(30)18-9-5-6-10-19(18)25(29)31/h2-14,20-21H,1H3/t20-,21+,28?/m0/s1
InChIKey HNDYTGIOSMIORW-PBJGFXAXSA-N
Mol Weight 422.44 g/mol
Molecular Formula C25H18N4O3
Exact Mass 422.13789 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HOUbYiikShR
Name 3-(4-Methylphenyl)-5-[rel-(2R,3S)-3-phenyl-1-phthalimidoaziridin-2-yl]-1,2,4-oxadiazole
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H18N4O3
InChI InChI=1S/C25H18N4O3/c1-15-11-13-17(14-12-15)22-26-23(32-27-22)21-20(16-7-3-2-4-8-16)28(21)29-24(30)18-9-5-6-10-19(18)25(29)31/h2-14,20-21H,1H3/t20-,21+,28?/m0/s1
InChIKey HNDYTGIOSMIORW-PBJGFXAXSA-N
Molecular Weight 422.444 g/mol
SMILES C1(N(N2[C@@](c3nc(-c4ccc(cc4)C)no3)([C@@]2(c2ccccc2)[H])[H])C(c2ccccc12)=O)=O
SPLASH splash10-0uk9-1940100000-134eba04160fcc6138d9
Source of Spectrum O1-46-681-3a
Wiley ID 1669217