CID 75807

1-methyl-2-phenylbenzimidazole

Structural Information

Molecular Formula
C14H12N2
SMILES
CN1C2=CC=CC=C2N=C1C3=CC=CC=C3
InChI
InChI=1S/C14H12N2/c1-16-13-10-6-5-9-12(13)15-14(16)11-7-3-2-4-8-11/h2-10H,1H3
InChIKey
POSRBSJJCMKQNU-UHFFFAOYSA-N
Compound name
1-methyl-2-phenylbenzimidazole
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

541
Patents

208.10005 Da
Monoisotopic Mass

3.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 209.10733 144.4
[M+Na]+ 231.08927 155.5
[M-H]- 207.09277 150.2
[M+NH4]+ 226.13387 163.7
[M+K]+ 247.06321 150.3
[M+H-H2O]+ 191.09731 136.1
[M+HCOO]- 253.09825 168.2
[M+CH3COO]- 267.11390 158.4
[M+Na-2H]- 229.07472 152.3
[M]+ 208.09950 146.3
[M]- 208.10060 146.3
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