CID 162636

2-amino-1h-benzo[d]imidazol-5-ol

Structural Information

Molecular Formula
C7H7N3O
SMILES
C1=CC2=C(C=C1O)NC(=N2)N
InChI
InChI=1S/C7H7N3O/c8-7-9-5-2-1-4(11)3-6(5)10-7/h1-3,11H,(H3,8,9,10)
InChIKey
FNSYWIPPPFVBAV-UHFFFAOYSA-N
Compound name
2-amino-3H-benzimidazol-5-ol
Related CIDs

2D Structure

compound 2d structure
3
Annotation Hits

3
References

29
Patents

149.05891 Da
Monoisotopic Mass

0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 150.066186 126.4
[M+Na]+ 172.048128 137.3
[M-H]- 148.051634 126.5
[M+NH4]+ 167.092733 146.5
[M+K]+ 188.022068 133.1
[M+H-H2O]+ 132.056170 120.3
[M+HCOO]- 194.057111 148.8
[M+CH3COO]- 208.072761 140.2
[M+Na-2H]- 170.033576 134.5
[M]+ 149.05836142 124.5
[M]- 149.05945858 124.5
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