4-Amino-2-(p-tolyl)-5H-[1]benzopyrano[4,3-d]pyrimidin-5-one(32644-47-6) IR1

Product Name4-Amino-2-(p-tolyl)-5H-[1]benzopyrano[4,3-d]pyrimidin-5-one

Molecular Formula

Molecular Weight

InChIInChI=1S/C18H13N3O2/c1-10-6-8-11(9-7-10)17-20-15-12-4-2-3-5-13(12)23-18(22)14(15)16(19)21-17/h2-9H,1H3,(H2,19,20,21)

InChIKey ORKCXIRIOXYGPQ-UHFFFAOYSA-N

SmilesC1(C2=CC=C(C)C=C2)=NC(N)=C2C(=O)OC3=CC=CC=C3C2=N1

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¹³CNMR

IR1

       ppm   Int.  Assign.

      166.55   135      1
      163.39   292      2
      160.91   202      3
      159.30   152      4
      153.49   393      5
      141.96   461      6
      134.22   404      7
      133.86   455      8
      129.12  1000      9
      128.78   904     10
      125.18   466     11 *
      124.86   489     12 *
      118.22   287     13
      116.81   500     14
       95.23   163     15
       20.99   478     16

Spectral Code: 13C NMR : in DMSO-d6

Spectral Code: IR : KBr disc

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