CID 20670469

38489-24-6

Structural Information

Molecular Formula
C20H18N4O4
SMILES
CC1=CC(=C(C=C1)NC(=O)C(C(=O)C)N=NC2=CC3=C(C=C2)C(=O)NC3=O)C
InChI
InChI=1S/C20H18N4O4/c1-10-4-7-16(11(2)8-10)21-20(28)17(12(3)25)24-23-13-5-6-14-15(9-13)19(27)22-18(14)26/h4-9,17H,1-3H3,(H,21,28)(H,22,26,27)
InChIKey
GJGFLTAKFLXPES-UHFFFAOYSA-N
Compound name
N-(2,4-dimethylphenyl)-2-[(1,3-dioxoisoindol-5-yl)diazenyl]-3-oxobutanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

28
Patents

378.1328 Da
Monoisotopic Mass

3.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 379.14008 187.4
[M+Na]+ 401.12202 193.7
[M-H]- 377.12552 195.6
[M+NH4]+ 396.16662 200.2
[M+K]+ 417.09596 190.5
[M+H-H2O]+ 361.13006 178.5
[M+HCOO]- 423.13100 210.6
[M+CH3COO]- 437.14665 230.4
[M+Na-2H]- 399.10747 187.5
[M]+ 378.13225 189.1
[M]- 378.13335 189.1
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

patents stripe