CID 15289584

64341-20-4

Structural Information

Molecular Formula
C6H8N4O
SMILES
C1=CC=NC(=C1)NC(=O)NN
InChI
InChI=1S/C6H8N4O/c7-10-6(11)9-5-3-1-2-4-8-5/h1-4H,7H2,(H2,8,9,10,11)
InChIKey
BGCDDMALTCVQBP-UHFFFAOYSA-N
Compound name
1-amino-3-pyridin-2-ylurea
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

55
Patents

152.06981 Da
Monoisotopic Mass

-0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 153.07709 128.7
[M+Na]+ 175.05903 134.9
[M-H]- 151.06253 130.7
[M+NH4]+ 170.10363 147.1
[M+K]+ 191.03297 133.5
[M+H-H2O]+ 135.06707 121.3
[M+HCOO]- 197.06801 154.9
[M+CH3COO]- 211.08366 179.8
[M+Na-2H]- 173.04448 137.3
[M]+ 152.06926 124.7
[M]- 152.07036 124.7
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe