CID 24694539

4-(1h-1,3-benzodiazol-1-ylmethyl)benzene-1-carboximidamide dihydrochloride

Structural Information

Molecular Formula
C15H14N4
SMILES
C1=CC=C2C(=C1)N=CN2CC3=CC=C(C=C3)C(=N)N
InChI
InChI=1S/C15H14N4/c16-15(17)12-7-5-11(6-8-12)9-19-10-18-13-3-1-2-4-14(13)19/h1-8,10H,9H2,(H3,16,17)
InChIKey
OEXWIKGFJXSSRU-UHFFFAOYSA-N
Compound name
4-(benzimidazol-1-ylmethyl)benzenecarboximidamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

250.12184 Da
Monoisotopic Mass

2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 251.12912 156.3
[M+Na]+ 273.11106 170.0
[M+NH4]+ 268.15566 164.5
[M+K]+ 289.08500 164.3
[M-H]- 249.11456 161.0
[M+Na-2H]- 271.09651 165.2
[M]+ 250.12129 159.4
[M]- 250.12239 159.4
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.