CID 393986

4-((1h-benzo[d]imidazol-2-yl)methyl)phenol

Structural Information

Molecular Formula
C14H12N2O
SMILES
C1=CC=C2C(=C1)NC(=N2)CC3=CC=C(C=C3)O
InChI
InChI=1S/C14H12N2O/c17-11-7-5-10(6-8-11)9-14-15-12-3-1-2-4-13(12)16-14/h1-8,17H,9H2,(H,15,16)
InChIKey
BGTLUMBJNNLMAH-UHFFFAOYSA-N
Compound name
4-(1H-benzimidazol-2-ylmethyl)phenol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

19
Patents

224.09496 Da
Monoisotopic Mass

2.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 225.10224 148.1
[M+Na]+ 247.08418 158.2
[M-H]- 223.08768 151.3
[M+NH4]+ 242.12878 165.2
[M+K]+ 263.05812 151.9
[M+H-H2O]+ 207.09222 140.3
[M+HCOO]- 269.09316 169.1
[M+CH3COO]- 283.10881 160.6
[M+Na-2H]- 245.06963 155.2
[M]+ 224.09441 147.8
[M]- 224.09551 147.8
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.