CID 765290

4-phenyl-1h-imidazole-1,2-diamine

Structural Information

Molecular Formula
C9H10N4
SMILES
C1=CC=C(C=C1)C2=CN(C(=N2)N)N
InChI
InChI=1S/C9H10N4/c10-9-12-8(6-13(9)11)7-4-2-1-3-5-7/h1-6H,11H2,(H2,10,12)
InChIKey
PDRGDRQVKOPWFY-UHFFFAOYSA-N
Compound name
4-phenylimidazole-1,2-diamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

6
References

46
Patents

174.09055 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 175.09783 134.8
[M+Na]+ 197.07977 143.8
[M-H]- 173.08327 138.9
[M+NH4]+ 192.12437 153.3
[M+K]+ 213.05371 140.1
[M+H-H2O]+ 157.08781 126.7
[M+HCOO]- 219.08875 160.0
[M+CH3COO]- 233.10440 148.2
[M+Na-2H]- 195.06522 140.6
[M]+ 174.09000 131.5
[M]- 174.09110 131.5
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