CID 9609885

2-(2-(4-butoxybenzylidene)hydrazino)-n-(4-methylphenyl)-2-oxoacetamide

Structural Information

Molecular Formula
C20H23N3O3
SMILES
CCCCOC1=CC=C(C=C1)/C=N/NC(=O)C(=O)NC2=CC=C(C=C2)C
InChI
InChI=1S/C20H23N3O3/c1-3-4-13-26-18-11-7-16(8-12-18)14-21-23-20(25)19(24)22-17-9-5-15(2)6-10-17/h5-12,14H,3-4,13H2,1-2H3,(H,22,24)(H,23,25)/b21-14+
InChIKey
GXOFYSPDRVZSJY-KGENOOAVSA-N
Compound name
N'-[(E)-(4-butoxyphenyl)methylideneamino]-N-(4-methylphenyl)oxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

353.17395 Da
Monoisotopic Mass

4.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 354.18123 186.0
[M+Na]+ 376.16317 189.8
[M-H]- 352.16667 193.3
[M+NH4]+ 371.20777 198.3
[M+K]+ 392.13711 186.6
[M+H-H2O]+ 336.17121 176.1
[M+HCOO]- 398.17215 212.0
[M+CH3COO]- 412.18780 222.8
[M+Na-2H]- 374.14862 188.6
[M]+ 353.17340 188.1
[M]- 353.17450 188.1
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.