CID 3613437

1-[(2-methylphenyl)methyl]-1h-1,3-benzodiazol-2-amine hydrochloride

Structural Information

Molecular Formula
C15H15N3
SMILES
CC1=CC=CC=C1CN2C3=CC=CC=C3N=C2N
InChI
InChI=1S/C15H15N3/c1-11-6-2-3-7-12(11)10-18-14-9-5-4-8-13(14)17-15(18)16/h2-9H,10H2,1H3,(H2,16,17)
InChIKey
IYSAPXLMYUJKGK-UHFFFAOYSA-N
Compound name
1-[(2-methylphenyl)methyl]benzimidazol-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

237.1266 Da
Monoisotopic Mass

3.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 238.13388 153.5
[M+Na]+ 260.11582 169.3
[M+NH4]+ 255.16042 162.7
[M+K]+ 276.08976 162.6
[M-H]- 236.11932 158.6
[M+Na-2H]- 258.10127 163.0
[M]+ 237.12605 157.3
[M]- 237.12715 157.3
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.