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1-(3-cyano-4-(furan-2yl)-5,6-dimethylpyridin-2-yl)urea
SpectraBase Compound ID 1Lg7WXWCczd
InChI InChI=1S/C13H12N4O2/c1-7-8(2)16-12(17-13(15)18)9(6-14)11(7)10-4-3-5-19-10/h3-5H,1-2H3,(H3,15,16,17,18)
InChIKey KIWPSPHVRQNEOF-UHFFFAOYSA-N
Mol Weight 256.26 g/mol
Molecular Formula C13H12N4O2
Exact Mass 256.096026 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6S1DIndDtRZ
Name 1-(3-cyano-4-(furan-2yl)-5,6-dimethylpyridin-2-yl)urea
Appearance Black crystals
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Formula C13H12N4O2
InChI InChI=1S/C13H12N4O2/c1-7-8(2)16-12(17-13(15)18)9(6-14)11(7)10-4-3-5-19-10/h3-5H,1-2H3,(H3,15,16,17,18)
InChIKey KIWPSPHVRQNEOF-UHFFFAOYSA-N
Instrument Name Kratos MS or Varian MAT 331 A
Ionization Type EI
Literature Reference DOI 10.1002/jhet.3584
Molecular Weight 256.265 g/mol
SMILES N(c1nc(c(c(c1C#N)-c1occc1)C)C)C(=O)N
SPLASH splash10-03di-0090000000-f45224209dff05b26570
Source of Spectrum Y-56-2042-9
Wiley ID 1859604