CID 83449288

912765-24-3

Structural Information

Molecular Formula
C14H13N3
SMILES
CN1C=NC2=C1C=CC(=C2)NC3=CC=CC=C3
InChI
InChI=1S/C14H13N3/c1-17-10-15-13-9-12(7-8-14(13)17)16-11-5-3-2-4-6-11/h2-10,16H,1H3
InChIKey
FEUKXSGSRAHNOK-UHFFFAOYSA-N
Compound name
1-methyl-N-phenylbenzimidazol-5-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

223.11095 Da
Monoisotopic Mass

3.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 224.11823 147.6
[M+Na]+ 246.10017 157.8
[M-H]- 222.10367 153.5
[M+NH4]+ 241.14477 166.0
[M+K]+ 262.07411 152.6
[M+H-H2O]+ 206.10821 139.0
[M+HCOO]- 268.10915 172.5
[M+CH3COO]- 282.12480 161.1
[M+Na-2H]- 244.08562 156.2
[M]+ 223.11040 148.9
[M]- 223.11150 148.9
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.