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2-[chloranyl-(4-nitrophenyl)methyl]-4,4-dimethyl-5H-1,3-oxazole
SpectraBase Compound ID JfxcqC25fGt
InChI InChI=1S/C12H13ClN2O3/c1-12(2)7-18-11(14-12)10(13)8-3-5-9(6-4-8)15(16)17/h3-6,10H,7H2,1-2H3
InChIKey PXIRLPFYUYBQDT-UHFFFAOYSA-N
Mol Weight 268.7 g/mol
Molecular Formula C12H13ClN2O3
Exact Mass 268.06147 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JDvdxD0BZvx
Name 2-[chloranyl-(4-nitrophenyl)methyl]-4,4-dimethyl-5H-1,3-oxazole
Alternate Name(s) 2-[chloro-(4-nitrophenyl)methyl]-4,4-dimethyl-2-oxazoline 2-[chloro-(4-nitrophenyl)methyl]-4,4-dimethyl-5H-1,3-oxazole 2-[chloro-(4-nitrophenyl)methyl]-4,4-dimethyl-5H-oxazole
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Formula C12H13ClN2O3
InChI InChI=1S/C12H13ClN2O3/c1-12(2)7-18-11(14-12)10(13)8-3-5-9(6-4-8)15(16)17/h3-6,10H,7H2,1-2H3
InChIKey PXIRLPFYUYBQDT-UHFFFAOYSA-N
Molecular Weight 268.700 g/mol
SMILES C1(=NC(C)(C)CO1)C(c1ccc(N(=O)=O)cc1)Cl
SPLASH splash10-001i-0190000000-907ad941b92ef12845df
Source of Spectrum K1-2003-4058-20
Wiley ID 1521799