CID 15959135

Chembl66573

Structural Information

Molecular Formula
C17H16N2O
SMILES
C1CN2C(=N1)C3=CC=CC=C3C2(CC4=CC=CC=C4)O
InChI
InChI=1S/C17H16N2O/c20-17(12-13-6-2-1-3-7-13)15-9-5-4-8-14(15)16-18-10-11-19(16)17/h1-9,20H,10-12H2
InChIKey
JHQIKKOEJLQAHC-UHFFFAOYSA-N
Compound name
5-benzyl-2,3-dihydroimidazo[1,2-b]isoindol-5-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

7
References

0
Patents

264.12625 Da
Monoisotopic Mass

1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 265.13353 161.2
[M+Na]+ 287.11547 170.7
[M-H]- 263.11897 166.5
[M+NH4]+ 282.16007 182.0
[M+K]+ 303.08941 164.7
[M+H-H2O]+ 247.12351 153.1
[M+HCOO]- 309.12445 180.6
[M+CH3COO]- 323.14010 173.2
[M+Na-2H]- 285.10092 165.7
[M]+ 264.12570 160.9
[M]- 264.12680 160.9
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.