CID 486944

2(1h)-pyridinone, 3-(dimethylamino)-5-ethyl-6-methyl-4-(3-methylphenyl)acetyl-

Structural Information

Molecular Formula
C19H24N2O2
SMILES
CCC1=C(NC(=O)C(=C1C(=O)CC2=CC=CC(=C2)C)N(C)C)C
InChI
InChI=1S/C19H24N2O2/c1-6-15-13(3)20-19(23)18(21(4)5)17(15)16(22)11-14-9-7-8-12(2)10-14/h7-10H,6,11H2,1-5H3,(H,20,23)
InChIKey
MXSPCAMPGUPKIA-UHFFFAOYSA-N
Compound name
3-(dimethylamino)-5-ethyl-6-methyl-4-[2-(3-methylphenyl)acetyl]-1H-pyridin-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

312.18378 Da
Monoisotopic Mass

2.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 313.19106 174.9
[M+Na]+ 335.17300 182.9
[M-H]- 311.17650 180.9
[M+NH4]+ 330.21760 188.5
[M+K]+ 351.14694 178.8
[M+H-H2O]+ 295.18104 166.3
[M+HCOO]- 357.18198 196.0
[M+CH3COO]- 371.19763 214.8
[M+Na-2H]- 333.15845 174.8
[M]+ 312.18323 177.8
[M]- 312.18433 177.8
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

No patent data available for this compound.