CID 3059787

77234-84-5

Structural Information

Molecular Formula
C17H22N2O
SMILES
C1CCC(CC1)C2=CC=C(C=C2)C(CN3C=CN=C3)O
InChI
InChI=1S/C17H22N2O/c20-17(12-19-11-10-18-13-19)16-8-6-15(7-9-16)14-4-2-1-3-5-14/h6-11,13-14,17,20H,1-5,12H2
InChIKey
KVRFDUMBYULIRY-UHFFFAOYSA-N
Compound name
1-(4-cyclohexylphenyl)-2-imidazol-1-ylethanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

3
Patents

270.17322 Da
Monoisotopic Mass

3.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 271.18050 164.9
[M+Na]+ 293.16244 168.4
[M-H]- 269.16594 169.4
[M+NH4]+ 288.20704 178.6
[M+K]+ 309.13638 163.7
[M+H-H2O]+ 253.17048 155.1
[M+HCOO]- 315.17142 181.1
[M+CH3COO]- 329.18707 174.3
[M+Na-2H]- 291.14789 165.6
[M]+ 270.17267 159.2
[M]- 270.17377 159.2
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