CID 73426985

1581304-48-4

Structural Information

Molecular Formula
C17H11Cl2N3O3
SMILES
C1=CC=C(C=C1)C(=O)NC2=CC(=C(C(=C2)Cl)OC3=NNC(=O)C=C3)Cl
InChI
InChI=1S/C17H11Cl2N3O3/c18-12-8-11(20-17(24)10-4-2-1-3-5-10)9-13(19)16(12)25-15-7-6-14(23)21-22-15/h1-9H,(H,20,24)(H,21,23)
InChIKey
PVWOISGEXDNRKY-UHFFFAOYSA-N
Compound name
N-[3,5-dichloro-4-[(6-oxo-1H-pyridazin-3-yl)oxy]phenyl]benzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

57
Patents

375.01776 Da
Monoisotopic Mass

3.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 376.02504 179.6
[M+Na]+ 398.00698 189.5
[M-H]- 374.01048 185.2
[M+NH4]+ 393.05158 189.0
[M+K]+ 413.98092 181.8
[M+H-H2O]+ 358.01502 170.3
[M+HCOO]- 420.01596 191.3
[M+CH3COO]- 434.03161 189.4
[M+Na-2H]- 395.99243 183.6
[M]+ 375.01721 183.0
[M]- 375.01831 183.0
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