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2-Ethyl-3-((2S,3R)-2-isobutyryl-3-phenyl-aziridin-1-yl)-3H-quinazolin-4-one
SpectraBase Compound ID 4mqV7AaGbjq
InChI InChI=1S/C22H23N3O2/c1-4-18-23-17-13-9-8-12-16(17)22(27)24(18)25-19(15-10-6-5-7-11-15)20(25)21(26)14(2)3/h5-14,19-20H,4H2,1-3H3/t19-,20+,25?/m1/s1
InChIKey IAYLSULYZYMVAE-DRNDDYJUSA-N
Mol Weight 361.45 g/mol
Molecular Formula C22H23N3O2
Exact Mass 361.179027 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1FqLWwjqnQK
Name 2-Ethyl-3-((2S,3R)-2-isobutyryl-3-phenyl-aziridin-1-yl)-3H-quinazolin-4-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H23N3O2
InChI InChI=1S/C22H23N3O2/c1-4-18-23-17-13-9-8-12-16(17)22(27)24(18)25-19(15-10-6-5-7-11-15)20(25)21(26)14(2)3/h5-14,19-20H,4H2,1-3H3/t19-,20+,25?/m1/s1
InChIKey IAYLSULYZYMVAE-DRNDDYJUSA-N
Molecular Weight 361.445 g/mol
SMILES C1(N(N2[C@@](C(=O)C(C)C)([H])[C@]2(c2ccccc2)[H])C(=Nc2ccccc12)CC)=O
SPLASH splash10-00kf-0690000000-37dd2d98252bb325f27b
Source of Spectrum KC-0-2126-16
Wiley ID 828620