CID 109953

1,2,3,5-benzenetetracarbonyl tetrachloride

Structural Information

Molecular Formula
C10H2Cl4O4
SMILES
C1=C(C=C(C(=C1C(=O)Cl)C(=O)Cl)C(=O)Cl)C(=O)Cl
InChI
InChI=1S/C10H2Cl4O4/c11-7(15)3-1-4(8(12)16)6(10(14)18)5(2-3)9(13)17/h1-2H
InChIKey
MANRPJCKLHWREF-UHFFFAOYSA-N
Compound name
benzene-1,2,3,5-tetracarbonyl chloride
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

325.87073 Da
Monoisotopic Mass

4.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 326.87801 151.3
[M+Na]+ 348.85995 161.5
[M-H]- 324.86345 153.1
[M+NH4]+ 343.90455 166.6
[M+K]+ 364.83389 156.6
[M+H-H2O]+ 308.86799 150.0
[M+HCOO]- 370.86893 153.5
[M+CH3COO]- 384.88458 205.1
[M+Na-2H]- 346.84540 150.0
[M]+ 325.87018 156.1
[M]- 325.87128 156.1
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.