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Methyl 1-(2-ethyl-4-oxoquinazolin-3-yl)-2-(2-methylpropanoyl)aziridine-2-carboxylate
SpectraBase Compound ID 81NAyFqWCVL
InChI InChI=1S/C18H21N3O4/c1-4-8-14(22)18(17(24)25-3)11-20(18)21-15(5-2)19-13-10-7-6-9-12(13)16(21)23/h6-7,9-10H,4-5,8,11H2,1-3H3/t18-,20?/m0/s1
InChIKey DKRRZDJISBYYLQ-LROBGIAVSA-N
Mol Weight 343.38 g/mol
Molecular Formula C18H21N3O4
Exact Mass 343.153206 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3Is6CIKrAHl
Name Methyl 1-(2-ethyl-4-oxoquinazolin-3-yl)-2-(2-methylpropanoyl)aziridine-2-carboxylate
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Formula C18H21N3O4
InChI InChI=1S/C18H21N3O4/c1-4-8-14(22)18(17(24)25-3)11-20(18)21-15(5-2)19-13-10-7-6-9-12(13)16(21)23/h6-7,9-10H,4-5,8,11H2,1-3H3/t18-,20?/m0/s1
InChIKey DKRRZDJISBYYLQ-LROBGIAVSA-N
Molecular Weight 343.383 g/mol
SMILES [C@@]1(N(C1)N1C(c2ccccc2N=C1CC)=O)(C(=O)OC)C(=O)CCC
SPLASH splash10-0089-0902000000-f5cae929bfda34ce52f7
Source of Spectrum KC-0-1957-18
Synonyms (1R,2S)-Methyl 1-(2-ethyl-4-oxoquinazolin-3-yl)-2-(butanoyl)aziridine-2-carboxylate Methyl 1-(2-ethyl-4-oxo-3(4H)-quinazolinyl)-2-isobutyryl-2-aziridinecarboxylate
Wiley ID 786257