CID 84973

4,4'-diamidinodiphenylamine dihydrochloride

Structural Information

Molecular Formula
C14H15N5
SMILES
C1=CC(=CC=C1C(=N)N)NC2=CC=C(C=C2)C(=N)N
InChI
InChI=1S/C14H15N5/c15-13(16)9-1-5-11(6-2-9)19-12-7-3-10(4-8-12)14(17)18/h1-8,19H,(H3,15,16)(H3,17,18)
InChIKey
OOSANNOCGQRXSP-UHFFFAOYSA-N
Compound name
4-(4-carbamimidoylanilino)benzenecarboximidamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

4
References

0
Patents

253.13275 Da
Monoisotopic Mass

1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 254.14003 156.7
[M+Na]+ 276.12197 161.1
[M-H]- 252.12547 162.7
[M+NH4]+ 271.16657 171.2
[M+K]+ 292.09591 156.7
[M+H-H2O]+ 236.13001 148.3
[M+HCOO]- 298.13095 183.2
[M+CH3COO]- 312.14660 209.1
[M+Na-2H]- 274.10742 160.9
[M]+ 253.13220 148.7
[M]- 253.13330 148.7
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

No patent data available for this compound.