CID 53626

Denzimol

Structural Information

Molecular Formula
C19H20N2O
SMILES
C1=CC=C(C=C1)CCC2=CC=C(C=C2)C(CN3C=CN=C3)O
InChI
InChI=1S/C19H20N2O/c22-19(14-21-13-12-20-15-21)18-10-8-17(9-11-18)7-6-16-4-2-1-3-5-16/h1-5,8-13,15,19,22H,6-7,14H2
InChIKey
IAWIJHCUEPVIOO-UHFFFAOYSA-N
Compound name
2-imidazol-1-yl-1-[4-(2-phenylethyl)phenyl]ethanol
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

27
References

105
Patents

292.15756 Da
Monoisotopic Mass

3.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 293.16484 169.8
[M+Na]+ 315.14678 175.5
[M-H]- 291.15028 175.1
[M+NH4]+ 310.19138 182.8
[M+K]+ 331.12072 169.7
[M+H-H2O]+ 275.15482 159.7
[M+HCOO]- 337.15576 189.6
[M+CH3COO]- 351.17141 179.9
[M+Na-2H]- 313.13223 172.5
[M]+ 292.15701 169.0
[M]- 292.15811 169.0
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