CID 454356

145901-86-6

Structural Information

Molecular Formula
C16H20N2O
SMILES
CCC1=C(NC(=O)C(=C1)NCC2=CC=CC=C2C)C
InChI
InChI=1S/C16H20N2O/c1-4-13-9-15(16(19)18-12(13)3)17-10-14-8-6-5-7-11(14)2/h5-9,17H,4,10H2,1-3H3,(H,18,19)
InChIKey
FEWQVVPRCKZUTK-UHFFFAOYSA-N
Compound name
5-ethyl-6-methyl-3-[(2-methylphenyl)methylamino]-1H-pyridin-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

256.15756 Da
Monoisotopic Mass

3.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 257.16484 160.4
[M+Na]+ 279.14678 168.9
[M-H]- 255.15028 165.0
[M+NH4]+ 274.19138 175.7
[M+K]+ 295.12072 163.3
[M+H-H2O]+ 239.15482 152.4
[M+HCOO]- 301.15576 182.7
[M+CH3COO]- 315.17141 199.0
[M+Na-2H]- 277.13223 164.4
[M]+ 256.15701 160.4
[M]- 256.15811 160.4
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.