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1-[2-(1,1-dichloroethyl)-4-keto-5-methyl-quinazolin-3-yl]ethylenimine-2-carboxylic acid methyl ester
SpectraBase Compound ID 76IyfJoPsxa
InChI InChI=1S/C15H15Cl2N3O3/c1-8-5-4-6-9-11(8)12(21)20(14(18-9)15(2,16)17)19-7-10(19)13(22)23-3/h4-6,10H,7H2,1-3H3
InChIKey QZKVZFAYQGRLHS-UHFFFAOYSA-N
Mol Weight 356.21 g/mol
Molecular Formula C15H15Cl2N3O3
Exact Mass 355.049047 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AftwGkZKC
Name 1-[2-(1,1-dichloroethyl)-4-keto-5-methyl-quinazolin-3-yl]ethylenimine-2-carboxylic acid methyl ester
Alternate Name(s) 1-[2-(1,1-dichloroethyl)-5-methyl-4-oxo-3-quinazolinyl]-2-aziridinecarboxylic acid methyl ester Methyl 1-[2-(1,1-dichloroethyl)-5-methyl-4-oxo-quinazolin-3-yl]aziridine-2-carboxylate Methyl 1-[2-[1,1-bis(chloranyl)ethyl]-5-methyl-4-oxidanylidene-quinazolin-3-yl]aziridine-2-carboxylate
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Formula C15H15Cl2N3O3
InChI InChI=1S/C15H15Cl2N3O3/c1-8-5-4-6-9-11(8)12(21)20(14(18-9)15(2,16)17)19-7-10(19)13(22)23-3/h4-6,10H,7H2,1-3H3
InChIKey QZKVZFAYQGRLHS-UHFFFAOYSA-N
Molecular Weight 356.209 g/mol
SMILES C1(N(N2C(=Nc3c(C2=O)c(ccc3)C)C(Cl)(Cl)C)C1)C(=O)OC
SPLASH splash10-0ab9-0098000000-1ae04f82d735fa44eb14
Source of Spectrum KC-0-776-32
Wiley ID 828159