CID 5130347

4,5-dimethyl-2-phenyl-1h-imidazol-1-ol

Structural Information

Molecular Formula
C11H12N2O
SMILES
CC1=C(N(C(=N1)C2=CC=CC=C2)O)C
InChI
InChI=1S/C11H12N2O/c1-8-9(2)13(14)11(12-8)10-6-4-3-5-7-10/h3-7,14H,1-2H3
InChIKey
XIUXPALHIFLMJF-UHFFFAOYSA-N
Compound name
1-hydroxy-4,5-dimethyl-2-phenylimidazole
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

10
Patents

188.09496 Da
Monoisotopic Mass

2.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 189.10224 139.7
[M+Na]+ 211.08418 150.0
[M-H]- 187.08768 143.4
[M+NH4]+ 206.12878 158.4
[M+K]+ 227.05812 146.3
[M+H-H2O]+ 171.09222 132.4
[M+HCOO]- 233.09316 162.0
[M+CH3COO]- 247.10881 181.1
[M+Na-2H]- 209.06963 144.2
[M]+ 188.09441 140.3
[M]- 188.09551 140.3
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