CID 478564

1-(pyrazine-2-carbonylamino)-3-(4-pyridyl)urea

Structural Information

Molecular Formula
C11H10N6O2
SMILES
C1=CN=CC=C1NC(=O)NNC(=O)C2=NC=CN=C2
InChI
InChI=1S/C11H10N6O2/c18-10(9-7-13-5-6-14-9)16-17-11(19)15-8-1-3-12-4-2-8/h1-7H,(H,16,18)(H2,12,15,17,19)
InChIKey
FKGNJFPSBFUXDI-UHFFFAOYSA-N
Compound name
1-(pyrazine-2-carbonylamino)-3-pyridin-4-ylurea
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

258.08652 Da
Monoisotopic Mass

-0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 259.09380 154.5
[M+Na]+ 281.07574 160.0
[M-H]- 257.07924 157.4
[M+NH4]+ 276.12034 165.6
[M+K]+ 297.04968 157.0
[M+H-H2O]+ 241.08378 144.1
[M+HCOO]- 303.08472 178.0
[M+CH3COO]- 317.10037 198.1
[M+Na-2H]- 279.06119 164.1
[M]+ 258.08597 151.9
[M]- 258.08707 151.9
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.