Product NameBENZALBARBITURIC ACID
CAS27402-47-7
Molecular FormulaC11H8N2O3
Molecular Weight216.19
InChIInChI=1S/C11H8N2O3/c14-9-8(10(15)13-11(16)12-9)6-7-4-2-1-3-5-7/h1-6H,(H2,12,13,14,15,16)
InChIKey CMWDWOZYVQQAMI-UHFFFAOYSA-N
SmilesC1(=O)NC(=O)/C(=C\C2=CC=CC=C2)/C(=O)N1
Assign. Shift(ppm)
A *1 11.4 B *1 11.3 C 8.305 D 8.094 E 7.542 F 7.481
ppm Int. Assign.
163.63 415 1 161.74 408 2 155.22 360 3 150.44 468 4 133.28 971 5 132.75 427 6 132.49 339 7 128.26 1000 8 119.08 422 9
BENZALBARBITURIC ACID(27402-47-7) IR1 Atlas of Related Products
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