CID 75202

Phenol, 2-(1-methyl-1h-benzimidazol-2-yl)-

Structural Information

Molecular Formula
C14H12N2O
SMILES
CN1C2=CC=CC=C2N=C1C3=CC=CC=C3O
InChI
InChI=1S/C14H12N2O/c1-16-12-8-4-3-7-11(12)15-14(16)10-6-2-5-9-13(10)17/h2-9,17H,1H3
InChIKey
DBUIKLZNAQEAEE-UHFFFAOYSA-N
Compound name
2-(1-methylbenzimidazol-2-yl)phenol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

68
Patents

224.09496 Da
Monoisotopic Mass

2.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 225.10224 148.3
[M+Na]+ 247.08418 159.7
[M-H]- 223.08768 153.2
[M+NH4]+ 242.12878 166.5
[M+K]+ 263.05812 154.3
[M+H-H2O]+ 207.09222 140.4
[M+HCOO]- 269.09316 170.8
[M+CH3COO]- 283.10881 161.8
[M+Na-2H]- 245.06963 155.0
[M]+ 224.09441 150.2
[M]- 224.09551 150.2
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