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1-[2-(1,1-dichloroethyl)-4-keto-quinazolin-3-yl]ethylenimine-2-carboxylic acid methyl ester
SpectraBase Compound ID 8Gdg4U8WHIc
InChI InChI=1S/C14H13Cl2N3O3/c1-14(15,16)13-17-9-6-4-3-5-8(9)11(20)19(13)18-7-10(18)12(21)22-2/h3-6,10H,7H2,1-2H3
InChIKey AWLJSKACIGYJPL-UHFFFAOYSA-N
Mol Weight 342.18 g/mol
Molecular Formula C14H13Cl2N3O3
Exact Mass 341.033397 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID F74zM3tISse
Name 1-[2-(1,1-dichloroethyl)-4-keto-quinazolin-3-yl]ethylenimine-2-carboxylic acid methyl ester
Alternate Name(s) 1-[2-(1,1-dichloroethyl)-4-oxo-3-quinazolinyl]-2-aziridinecarboxylic acid methyl ester Methyl 1-[2-(1,1-dichloroethyl)-4-oxo-quinazolin-3-yl]aziridine-2-carboxylate Methyl 1-[2-[1,1-bis(chloranyl)ethyl]-4-oxidanylidene-quinazolin-3-yl]aziridine-2-carboxylate
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Formula C14H13Cl2N3O3
InChI InChI=1S/C14H13Cl2N3O3/c1-14(15,16)13-17-9-6-4-3-5-8(9)11(20)19(13)18-7-10(18)12(21)22-2/h3-6,10H,7H2,1-2H3
InChIKey AWLJSKACIGYJPL-UHFFFAOYSA-N
Molecular Weight 342.182 g/mol
SMILES C1(N(N2C(=Nc3c(C2=O)cccc3)C(Cl)(Cl)C)C1)C(=O)OC
SPLASH splash10-0a4i-0019000000-e2c7c91b549fdd552786
Source of Spectrum KC-0-775-31
Wiley ID 828160