CID 409362

N-(4-aminophenyl)guanidine

Structural Information

Molecular Formula
C7H10N4
SMILES
C1=CC(=CC=C1N)N=C(N)N
InChI
InChI=1S/C7H10N4/c8-5-1-3-6(4-2-5)11-7(9)10/h1-4H,8H2,(H4,9,10,11)
InChIKey
HXKWSIPCTVYMBN-UHFFFAOYSA-N
Compound name
2-(4-aminophenyl)guanidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

2
References

76
Patents

150.09055 Da
Monoisotopic Mass

-0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 151.09783 129.7
[M+Na]+ 173.07977 136.1
[M-H]- 149.08327 133.7
[M+NH4]+ 168.12437 149.6
[M+K]+ 189.05371 134.3
[M+H-H2O]+ 133.08781 122.9
[M+HCOO]- 195.08875 157.7
[M+CH3COO]- 209.10440 186.4
[M+Na-2H]- 171.06522 135.4
[M]+ 150.09000 123.7
[M]- 150.09110 123.7
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