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5-(4-Nitroimidazol-1-yl)-3-phenyl-4,5-dihydroisoxazole
SpectraBase Compound ID Gh6uZB7qrKn
InChI InChI=1S/C12H10N4O3/c17-16(18)11-7-15(8-13-11)12-6-10(14-19-12)9-4-2-1-3-5-9/h1-5,7-8,12H,6H2
InChIKey LPCSPKCVKSLBHR-UHFFFAOYSA-N
Mol Weight 258.24 g/mol
Molecular Formula C12H10N4O3
Exact Mass 258.07529 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5RjzIaHjXDl
Name 5-(4-Nitroimidazol-1-yl)-3-phenyl-4,5-dihydroisoxazole
Comments Less than 3 mono-isotopic peaks
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Formula C12H10N4O3
InChI InChI=1S/C12H10N4O3/c17-16(18)11-7-15(8-13-11)12-6-10(14-19-12)9-4-2-1-3-5-9/h1-5,7-8,12H,6H2
InChIKey LPCSPKCVKSLBHR-UHFFFAOYSA-N
Molecular Weight 258.237 g/mol
SMILES C1(=NOC(C1)[n]1cnc(c1)N(=O)=O)c1ccccc1
SPLASH splash10-0002-0900000000-070579d932edf6304eb8
Source of Spectrum F4-0-2699-20
Synonyms 5-(4-nitro-1H-imidazol-1-yl)-3-phenyl-4,5-dihydroisoxazole
Wiley ID 1618745