CID 3062169

Brn 5309985

Structural Information

Molecular Formula
C22H22N2O4
SMILES
CC1=CC(=O)C(=C(N1C2=CC=CC=C2OC)C)C(=O)NC3=CC=CC=C3OC
InChI
InChI=1S/C22H22N2O4/c1-14-13-18(25)21(22(26)23-16-9-5-7-11-19(16)27-3)15(2)24(14)17-10-6-8-12-20(17)28-4/h5-13H,1-4H3,(H,23,26)
InChIKey
KQEHSCPNXKOXRY-UHFFFAOYSA-N
Compound name
N,1-bis(2-methoxyphenyl)-2,6-dimethyl-4-oxopyridine-3-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

378.15796 Da
Monoisotopic Mass

3.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 379.16524 190.8
[M+Na]+ 401.14718 199.4
[M-H]- 377.15068 200.1
[M+NH4]+ 396.19178 201.1
[M+K]+ 417.12112 195.1
[M+H-H2O]+ 361.15522 180.0
[M+HCOO]- 423.15616 213.3
[M+CH3COO]- 437.17181 223.9
[M+Na-2H]- 399.13263 192.0
[M]+ 378.15741 195.5
[M]- 378.15851 195.5
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.