CID 324551

2-(2-selenophenyl)-1h-benzimidazole

Structural Information

Molecular Formula
C11H8N2Se
SMILES
C1=CC=C2C(=C1)NC(=N2)C3=CC=C[Se]3
InChI
InChI=1S/C11H8N2Se/c1-2-5-9-8(4-1)12-11(13-9)10-6-3-7-14-10/h1-7H,(H,12,13)
InChIKey
VPDDHKWMFCEDJP-UHFFFAOYSA-N
Compound name
2-selenophen-2-yl-1H-benzimidazole
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

247.98528 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 248.99256 148.4
[M+Na]+ 270.97450 158.4
[M-H]- 246.97800 152.6
[M+NH4]+ 266.01910 169.0
[M+K]+ 286.94844 153.2
[M+H-H2O]+ 230.98254 140.5
[M+HCOO]- 292.98348 171.7
[M+CH3COO]- 306.99913 161.6
[M+Na-2H]- 268.95995 153.6
[M]+ 247.98473 148.4
[M]- 247.98583 148.4
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.