CID 75511261

1h-imidazol-2-yl(pyridin-2-yl)methanol

Structural Information

Molecular Formula
C9H9N3O
SMILES
C1=CC=NC(=C1)C(C2=NC=CN2)O
InChI
InChI=1S/C9H9N3O/c13-8(9-11-5-6-12-9)7-3-1-2-4-10-7/h1-6,8,13H,(H,11,12)
InChIKey
OFBBGFDBSZQPJA-UHFFFAOYSA-N
Compound name
1H-imidazol-2-yl(pyridin-2-yl)methanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

3
Patents

175.07455 Da
Monoisotopic Mass

-0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 176.081826 135.9
[M+Na]+ 198.063768 143.4
[M-H]- 174.067274 136.0
[M+NH4]+ 193.108373 151.9
[M+K]+ 214.037708 139.7
[M+H-H2O]+ 158.071810 127.4
[M+HCOO]- 220.072751 154.9
[M+CH3COO]- 234.088401 147.7
[M+Na-2H]- 196.049216 141.9
[M]+ 175.07400142 132.6
[M]- 175.07509858 132.6
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