CID 3339960

2-(2h-benzimidazol-2-ylidene)-2h-benzimidazole

Structural Information

Molecular Formula
C14H8N4
SMILES
C1=CC2=NC(=C3N=C4C=CC=CC4=N3)N=C2C=C1
InChI
InChI=1S/C14H8N4/c1-2-6-10-9(5-1)15-13(16-10)14-17-11-7-3-4-8-12(11)18-14/h1-8H
InChIKey
GSBYVGWYBDISLZ-UHFFFAOYSA-N
Compound name
2-(benzimidazol-2-ylidene)benzimidazole
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

4
Patents

232.07489 Da
Monoisotopic Mass

0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 233.08217 149.4
[M+Na]+ 255.06411 163.0
[M-H]- 231.06761 154.5
[M+NH4]+ 250.10871 167.6
[M+K]+ 271.03805 156.5
[M+H-H2O]+ 215.07215 140.1
[M+HCOO]- 277.07309 172.6
[M+CH3COO]- 291.08874 163.1
[M+Na-2H]- 253.04956 157.4
[M]+ 232.07434 152.6
[M]- 232.07544 152.6
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