CID 3062176

80357-46-6

Structural Information

Molecular Formula

C₂₄H₂₆N₂O₆

SMILES

CC1=CC(=O)C(=C(N1C2=C(C=CC(=C2)OC)OC)C)C(=O)NC3=C(C=CC(=C3)OC)OC

InChI

InChI=1S/C24H26N2O6/c1-14-11-20(27)23(24(28)25-18-12-16(29-3)7-9-21(18)31-5)15(2)26(14)19-13-17(30-4)8-10-22(19)32-6/h7-13H,1-6H3,(H,25,28)

InChIKey

AWRIZEHFKOYTEE-UHFFFAOYSA-N

Compound name

N,1-bis(2,5-dimethoxyphenyl)-2,6-dimethyl-4-oxopyridine-3-carboxamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 1
References: 0
Patents: 438.17908 Da
Monoisotopic Mass: 3.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	439.186356	205.2
[M+Na]+	461.168298	214.0
[M-H]-	437.171804	214.8
[M+NH4]+	456.212903	213.3
[M+K]+	477.142238	211.3
[M+H-H2O]+	421.176340	193.8
[M+HCOO]-	483.177281	227.1
[M+CH3COO]-	497.192931	236.9
[M+Na-2H]-	459.153746	204.2
[M]+	438.17853142	214.2
[M]-	438.17962858	214.2

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.