CID 13691338

109461-15-6

Structural Information

Molecular Formula
C19H19N3O3
SMILES
CC1=CC=C(C=C1)C2=C(N3C=C(C=CC3=N2)C(=O)O)CC(=O)N(C)C
InChI
InChI=1S/C19H19N3O3/c1-12-4-6-13(7-5-12)18-15(10-17(23)21(2)3)22-11-14(19(24)25)8-9-16(22)20-18/h4-9,11H,10H2,1-3H3,(H,24,25)
InChIKey
RFUGIBAONXDHRM-UHFFFAOYSA-N
Compound name
3-[2-(dimethylamino)-2-oxoethyl]-2-(4-methylphenyl)imidazo[1,2-a]pyridine-6-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

8
Patents

337.14264 Da
Monoisotopic Mass

1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 338.14992 179.3
[M+Na]+ 360.13186 188.0
[M-H]- 336.13536 185.5
[M+NH4]+ 355.17646 192.8
[M+K]+ 376.10580 184.2
[M+H-H2O]+ 320.13990 170.4
[M+HCOO]- 382.14084 200.3
[M+CH3COO]- 396.15649 215.8
[M+Na-2H]- 358.11731 180.5
[M]+ 337.14209 184.0
[M]- 337.14319 184.0
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