CID 53624

77234-89-0

Structural Information

Molecular Formula
C19H20N2O
SMILES
CC(CN1C=CN=C1)C(C2=CC=C(C=C2)C3=CC=CC=C3)O
InChI
InChI=1S/C19H20N2O/c1-15(13-21-12-11-20-14-21)19(22)18-9-7-17(8-10-18)16-5-3-2-4-6-16/h2-12,14-15,19,22H,13H2,1H3
InChIKey
CLXBBIBLVPFFJA-UHFFFAOYSA-N
Compound name
3-imidazol-1-yl-2-methyl-1-(4-phenylphenyl)propan-1-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

292.15756 Da
Monoisotopic Mass

3.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 293.16484 169.9
[M+Na]+ 315.14678 175.3
[M-H]- 291.15028 175.4
[M+NH4]+ 310.19138 182.8
[M+K]+ 331.12072 170.0
[M+H-H2O]+ 275.15482 160.0
[M+HCOO]- 337.15576 188.7
[M+CH3COO]- 351.17141 180.0
[M+Na-2H]- 313.13223 171.5
[M]+ 292.15701 168.6
[M]- 292.15811 168.6
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