CID 164288

129958-47-0

Structural Information

Molecular Formula
C10H4Cl4O
SMILES
C1=COC(=C1)C=C2C(=C(C(=C2Cl)Cl)Cl)Cl
InChI
InChI=1S/C10H4Cl4O/c11-7-6(4-5-2-1-3-15-5)8(12)10(14)9(7)13/h1-4H
InChIKey
UFNDBKHPWLFHEI-UHFFFAOYSA-N
Compound name
2-[(2,3,4,5-tetrachlorocyclopenta-2,4-dien-1-ylidene)methyl]furan
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

279.9016 Da
Monoisotopic Mass

4.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 280.90888 163.7
[M+Na]+ 302.89082 175.7
[M-H]- 278.89432 167.9
[M+NH4]+ 297.93542 182.6
[M+K]+ 318.86476 169.3
[M+H-H2O]+ 262.89886 160.1
[M+HCOO]- 324.89980 168.3
[M+CH3COO]- 338.91545 175.3
[M+Na-2H]- 300.87627 162.1
[M]+ 279.90105 166.9
[M]- 279.90215 166.9
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.