CID 109115

61698-32-6

Structural Information

Molecular Formula
C11H12N2O2
SMILES
C1=CC=C(C=C1)C2=NC(=C(N2)CO)CO
InChI
InChI=1S/C11H12N2O2/c14-6-9-10(7-15)13-11(12-9)8-4-2-1-3-5-8/h1-5,14-15H,6-7H2,(H,12,13)
InChIKey
UUQQGGWZVKUCBD-UHFFFAOYSA-N
Compound name
[4-(hydroxymethyl)-2-phenyl-1H-imidazol-5-yl]methanol
Related CIDs

2D Structure

compound 2d structure
3
Annotation Hits

0
References

14677
Patents

204.08987 Da
Monoisotopic Mass

0.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 205.097146 143.9
[M+Na]+ 227.079088 152.2
[M-H]- 203.082594 144.5
[M+NH4]+ 222.123693 160.1
[M+K]+ 243.053028 147.3
[M+H-H2O]+ 187.087130 136.6
[M+HCOO]- 249.088071 163.4
[M+CH3COO]- 263.103721 177.1
[M+Na-2H]- 225.064536 148.2
[M]+ 204.08932142 141.8
[M]- 204.09041858 141.8
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