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Methyl 1-(2-ethyl-4-oxoquinazolin-3-yl)-2-(1-hydroxybutyl)aziridine-2-carboxylate
SpectraBase Compound ID 1D4WXQBMbV4
InChI InChI=1S/C18H23N3O4/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/h6-7,9-10,14,22H,4-5,8,11H2,1-3H3/t14-,18+,20?/m1/s1
InChIKey HHNOTXLEGUSINL-KJOMBKDJSA-N
Mol Weight 345.4 g/mol
Molecular Formula C18H23N3O4
Exact Mass 345.168856 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1fgBxw8hl8R
Name Methyl 1-(2-ethyl-4-oxoquinazolin-3-yl)-2-(1-hydroxybutyl)aziridine-2-carboxylate
Alternate Name(s) (1R,2S)-Methyl 1-(2-ethyl-4-oxoquinazolin-3-yl)-2-((R)-1-hydroxybutyl)aziridine-2-carboxylate Methyl 1-(2-ethyl-4-oxo-3(4H)-quinazolinyl)-2-(1-hydroxybutyl)-2-aziridinecarboxylate
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Formula C18H23N3O4
InChI InChI=1S/C18H23N3O4/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/h6-7,9-10,14,22H,4-5,8,11H2,1-3H3/t14-,18+,20?/m1/s1
InChIKey HHNOTXLEGUSINL-KJOMBKDJSA-N
Molecular Weight 345.399 g/mol
SMILES O[C@@]([C@]1(N(N2C(c3ccccc3N=C2CC)=O)C1)C(=O)OC)(CCC)[H]
SPLASH splash10-00e9-0910000000-df5961384070bfe602cd
Source of Spectrum KC-0-1958-29
Wiley ID 786252