CID 3054916

2-(1-(4-cyclohexylphenyl)-2-(1h-imidazol-1-yl)ethoxy)ethanol monohydrochloride

Structural Information

Molecular Formula
C19H26N2O2
SMILES
C1CCC(CC1)C2=CC=C(C=C2)C(CN3C=CN=C3)OCCO
InChI
InChI=1S/C19H26N2O2/c22-12-13-23-19(14-21-11-10-20-15-21)18-8-6-17(7-9-18)16-4-2-1-3-5-16/h6-11,15-16,19,22H,1-5,12-14H2
InChIKey
DSKNXNIXJFBMHV-UHFFFAOYSA-N
Compound name
2-[1-(4-cyclohexylphenyl)-2-imidazol-1-ylethoxy]ethanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

314.19943 Da
Monoisotopic Mass

3.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 315.20671 176.6
[M+Na]+ 337.18865 178.9
[M-H]- 313.19215 180.6
[M+NH4]+ 332.23325 188.3
[M+K]+ 353.16259 174.5
[M+H-H2O]+ 297.19669 166.1
[M+HCOO]- 359.19763 192.3
[M+CH3COO]- 373.21328 202.5
[M+Na-2H]- 335.17410 176.3
[M]+ 314.19888 172.9
[M]- 314.19998 172.9
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

No patent data available for this compound.