CID 32366

2-tert-butyl-1h-benzo[d]imidazole

Structural Information

Molecular Formula
C11H14N2
SMILES
CC(C)(C)C1=NC2=CC=CC=C2N1
InChI
InChI=1S/C11H14N2/c1-11(2,3)10-12-8-6-4-5-7-9(8)13-10/h4-7H,1-3H3,(H,12,13)
InChIKey
ZQWHWRQRGKZTSE-UHFFFAOYSA-N
Compound name
2-tert-butyl-1H-benzimidazole
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

8
References

715
Patents

174.11569 Da
Monoisotopic Mass

3.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 175.12297 137.8
[M+Na]+ 197.10491 151.4
[M+NH4]+ 192.14951 146.6
[M+K]+ 213.07885 146.6
[M-H]- 173.10841 138.9
[M+Na-2H]- 195.09036 144.8
[M]+ 174.11514 140.1
[M]- 174.11624 140.1
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