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(S)-N-[2-(1,2,2-Trimethylpropyl)-4-(3H)-oxoquinazolin-3-yl]-2-(chloromethyl)-3-phenylaziridine

View entire compound with spectra: 1 MS (GC)

(S)-N-[2-(1,2,2-Trimethylpropyl)-4-(3H)-oxoquinazolin-3-yl]-2-(chloromethyl)-3-phenylaziridine
SpectraBase Compound ID FBhn8AuoCrR
InChI InChI=1S/C23H26ClN3O/c1-15(23(2,3)4)21-25-18-13-9-8-12-17(18)22(28)27(21)26-19(14-24)20(26)16-10-6-5-7-11-16/h5-13,15,19-20H,14H2,1-4H3/t15?,19-,20?,26?/m1/s1
InChIKey BCRIDEPOJKLIDP-OGKHVRCVSA-N
Mol Weight 395.93 g/mol
Molecular Formula C23H26ClN3O
Exact Mass 395.17644 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9SJ3kMwgCoM
Name (S)-N-[2-(1,2,2-Trimethylpropyl)-4-(3H)-oxoquinazolin-3-yl]-2-(chloromethyl)-3-phenylaziridine
Alternate Name(s) 3-[(2S)-2-(chloromethyl)-3-phenylaziridinyl]-2-(1,2,2-trimethylpropyl)-4(3H)-quinazolinone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H26ClN3O
InChI InChI=1S/C23H26ClN3O/c1-15(23(2,3)4)21-25-18-13-9-8-12-17(18)22(28)27(21)26-19(14-24)20(26)16-10-6-5-7-11-16/h5-13,15,19-20H,14H2,1-4H3/t15?,19-,20?,26?/m1/s1
InChIKey BCRIDEPOJKLIDP-OGKHVRCVSA-N
Molecular Weight 395.934 g/mol
SMILES C=1(N(N2[C@](CCl)(C2c2ccccc2)[H])C(c2c(N1)cccc2)=O)C(C(C)(C)C)C
SPLASH splash10-015a-2903000000-ea8bdbdc9c084ac56b71
Source of Spectrum K-2002-827-40
Wiley ID 1581375