CID 360329

Nsc622377

Structural Information

Molecular Formula
C10H2Cl5NO2
SMILES
C1=CC(=C(C(=C1N2C(=O)C(=C(C2=O)Cl)Cl)Cl)Cl)Cl
InChI
InChI=1S/C10H2Cl5NO2/c11-3-1-2-4(6(13)5(3)12)16-9(17)7(14)8(15)10(16)18/h1-2H
InChIKey
KFORIHBASFONEJ-UHFFFAOYSA-N
Compound name
3,4-dichloro-1-(2,3,4-trichlorophenyl)pyrrole-2,5-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

342.8528 Da
Monoisotopic Mass

4.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 343.86008 169.8
[M+Na]+ 365.84202 182.0
[M-H]- 341.84552 170.5
[M+NH4]+ 360.88662 184.2
[M+K]+ 381.81596 176.0
[M+H-H2O]+ 325.85006 165.6
[M+HCOO]- 387.85100 166.9
[M+CH3COO]- 401.86665 208.6
[M+Na-2H]- 363.82747 165.7
[M]+ 342.85225 170.9
[M]- 342.85335 170.9
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.