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Methyl 1-(2-ethyl-4-oxoquinazolin-3-yl)-2-(1-acetoxy-3-methylbutyl)aziridine-2-carboxylate
SpectraBase Compound ID JmvmFLCCIcV
InChI InChI=1S/C21H27N3O5/c1-6-18-22-16-10-8-7-9-15(16)19(26)24(18)23-12-21(23,20(27)28-5)17(11-13(2)3)29-14(4)25/h7-10,13,17H,6,11-12H2,1-5H3/t17-,21+,23?/m1/s1
InChIKey QWTJYUVECDDQFX-XGASYVDGSA-N
Mol Weight 401.46 g/mol
Molecular Formula C21H27N3O5
Exact Mass 401.195071 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FzXJ6iS96u1
Name Methyl 1-(2-ethyl-4-oxoquinazolin-3-yl)-2-(1-acetoxy-3-methylbutyl)aziridine-2-carboxylate
Alternate Name(s) (1R,2S)-Methyl 1-(2-ethyl-4-oxoquinazolin-3-yl)-2-((R)-1-acetoxy-3-methylbutyl)aziridine-2-carboxylate Methyl 2-[1-(acetyloxy)-3-methylbutyl]-1-(2-ethyl-4-oxo-3(4H)-quinazolinyl)-2-aziridinecarboxylate
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Formula C21H27N3O5
InChI InChI=1S/C21H27N3O5/c1-6-18-22-16-10-8-7-9-15(16)19(26)24(18)23-12-21(23,20(27)28-5)17(11-13(2)3)29-14(4)25/h7-10,13,17H,6,11-12H2,1-5H3/t17-,21+,23?/m1/s1
InChIKey QWTJYUVECDDQFX-XGASYVDGSA-N
Molecular Weight 401.463 g/mol
SMILES [C@]1(N(C1)N1C(c2ccccc2N=C1CC)=O)([C@](OC(=O)C)(CC(C)C)[H])C(=O)OC
SPLASH splash10-00di-0900000000-c5d6aca7a269e7d1ada6
Source of Spectrum KC-0-1959-31
Wiley ID 786251