CID 9948759

Zset-845

Structural Information

Molecular Formula
C21H18N2O
SMILES
C1=CC=C(C=C1)CC2(C(=O)N=C3N2C=CC=C3)CC4=CC=CC=C4
InChI
InChI=1S/C21H18N2O/c24-20-21(15-17-9-3-1-4-10-17,16-18-11-5-2-6-12-18)23-14-8-7-13-19(23)22-20/h1-14H,15-16H2
InChIKey
AGKKYNURMHHCFP-UHFFFAOYSA-N
Compound name
3,3-dibenzylimidazo[1,2-a]pyridin-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

2
References

65
Patents

314.1419 Da
Monoisotopic Mass

3.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 315.14918 176.2
[M+Na]+ 337.13112 192.8
[M+NH4]+ 332.17572 186.8
[M+K]+ 353.10506 182.5
[M-H]- 313.13462 182.7
[M+Na-2H]- 335.11657 188.3
[M]+ 314.14135 180.8
[M]- 314.14245 180.8
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