CID 15563710

2-(azidomethyl)-1h-benzo[d]imidazole

Structural Information

Molecular Formula
C8H7N5
SMILES
C1=CC=C2C(=C1)NC(=N2)CN=[N+]=[N-]
InChI
InChI=1S/C8H7N5/c9-13-10-5-8-11-6-3-1-2-4-7(6)12-8/h1-4H,5H2,(H,11,12)
InChIKey
APIBGQDLQSXNOW-UHFFFAOYSA-N
Compound name
2-(azidomethyl)-1H-benzimidazole
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

24
Patents

173.07014 Da
Monoisotopic Mass

2.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 174.07742 130.2
[M+Na]+ 196.05936 144.0
[M+NH4]+ 191.10396 139.1
[M+K]+ 212.03330 140.6
[M-H]- 172.06286 134.8
[M+Na-2H]- 194.04481 138.8
[M]+ 173.06959 133.2
[M]- 173.07069 133.2
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

patents stripe