CID 5331272

413590-99-5

Structural Information

Molecular Formula
C17H16Cl2N4O2
SMILES
CN(C)C1=CC=C(C=C1)/C=N/NC(=O)C(=O)NC2=C(C=CC(=C2)Cl)Cl
InChI
InChI=1S/C17H16Cl2N4O2/c1-23(2)13-6-3-11(4-7-13)10-20-22-17(25)16(24)21-15-9-12(18)5-8-14(15)19/h3-10H,1-2H3,(H,21,24)(H,22,25)/b20-10+
InChIKey
MQBCDHBDMHHPRE-KEBDBYFISA-N
Compound name
N-(2,5-dichlorophenyl)-N'-[(E)-[4-(dimethylamino)phenyl]methylideneamino]oxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

378.06503 Da
Monoisotopic Mass

3.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 379.07231 189.5
[M+Na]+ 401.05425 196.3
[M-H]- 377.05775 198.3
[M+NH4]+ 396.09885 203.0
[M+K]+ 417.02819 191.6
[M+H-H2O]+ 361.06229 182.0
[M+HCOO]- 423.06323 208.4
[M+CH3COO]- 437.07888 228.8
[M+Na-2H]- 399.03970 191.2
[M]+ 378.06448 194.3
[M]- 378.06558 194.3
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.