CID 3073610

5-benzofuranol, 2-(1h-imidazol-2-yl)-, monohydrochloride

Structural Information

Molecular Formula
C11H8N2O2
SMILES
C1=CC2=C(C=C1O)C=C(O2)C3=NC=CN3
InChI
InChI=1S/C11H8N2O2/c14-8-1-2-9-7(5-8)6-10(15-9)11-12-3-4-13-11/h1-6,14H,(H,12,13)
InChIKey
MQNGYVLSMBRUEO-UHFFFAOYSA-N
Compound name
2-(1H-imidazol-2-yl)-1-benzofuran-5-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

14
Patents

200.05858 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 201.065856 138.2
[M+Na]+ 223.047798 149.4
[M-H]- 199.051304 142.8
[M+NH4]+ 218.092403 156.9
[M+K]+ 239.021738 146.0
[M+H-H2O]+ 183.055840 131.8
[M+HCOO]- 245.056781 160.4
[M+CH3COO]- 259.072431 152.2
[M+Na-2H]- 221.033246 144.7
[M]+ 200.05803142 139.8
[M]- 200.05912858 139.8
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