CID 47003166

4-phenyl-1h-imidazole-1,5-diamine

Structural Information

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

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
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 135.7
[M+Na]+ 197.07977 147.7
[M+NH4]+ 192.12437 143.8
[M+K]+ 213.05371 143.7
[M-H]- 173.08327 139.5
[M+Na-2H]- 195.06522 143.9
[M]+ 174.09000 138.2
[M]- 174.09110 138.2
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.