CID 3069488

84775-00-8

Structural Information

Molecular Formula
C17H15ClN2O
SMILES
C1CN2C(=N1)C3=CC=CC=C3CC2(C4=CC(=CC=C4)Cl)O
InChI
InChI=1S/C17H15ClN2O/c18-14-6-3-5-13(10-14)17(21)11-12-4-1-2-7-15(12)16-19-8-9-20(16)17/h1-7,10,21H,8-9,11H2
InChIKey
VCXGTSVXQNAKCI-UHFFFAOYSA-N
Compound name
5-(3-chlorophenyl)-3,6-dihydro-2H-imidazo[2,1-a]isoquinolin-5-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

298.08728 Da
Monoisotopic Mass

2.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 299.09456 167.3
[M+Na]+ 321.07650 183.5
[M+NH4]+ 316.12110 178.8
[M+K]+ 337.05044 173.9
[M-H]- 297.08000 172.0
[M+Na-2H]- 319.06195 176.2
[M]+ 298.08673 171.6
[M]- 298.08783 171.6
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

No patent data available for this compound.