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2-(2,4-dinitrobenzyl)-4,4-dimethyl-2-oxazoline
SpectraBase Compound ID HdZy5UYkHKT
InChI InChI=1S/C12H13N3O5/c1-12(2)7-20-11(13-12)5-8-3-4-9(14(16)17)6-10(8)15(18)19/h3-4,6H,5,7H2,1-2H3
InChIKey AGSHKTZTJAOZNR-UHFFFAOYSA-N
Mol Weight 279.25 g/mol
Molecular Formula C12H13N3O5
Exact Mass 279.085521 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8fzTHgTj42M
Name 2-(2,4-dinitrobenzyl)-4,4-dimethyl-2-oxazoline
Alternate Name(s) 2-[(2,4-dinitrophenyl)methyl]-4,4-dimethyl-5H-1,3-oxazole 2-[(2,4-dinitrophenyl)methyl]-4,4-dimethyl-5H-oxazole
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Formula C12H13N3O5
InChI InChI=1S/C12H13N3O5/c1-12(2)7-20-11(13-12)5-8-3-4-9(14(16)17)6-10(8)15(18)19/h3-4,6H,5,7H2,1-2H3
InChIKey AGSHKTZTJAOZNR-UHFFFAOYSA-N
Molecular Weight 279.252 g/mol
SMILES C=1(OCC(N1)(C)C)Cc1c(cc(cc1)N(=O)=O)N(=O)=O
SPLASH splash10-01q9-6090000000-604c16766b97bf0d11ba
Source of Spectrum K1-2003-4057-12
Wiley ID 1521811