CID 123192

Cyclopentene, 4-(dichloromethylene)-1,2,3,3,5,5-hexachloro-

Structural Information

Molecular Formula
C6Cl8
SMILES
C1(=C(C(C(=C(Cl)Cl)C1(Cl)Cl)(Cl)Cl)Cl)Cl
InChI
InChI=1S/C6Cl8/c7-2-3(8)6(13,14)1(4(9)10)5(2,11)12
InChIKey
HSNOZNMQZFGXDR-UHFFFAOYSA-N
Compound name
1,2,3,3,5,5-hexachloro-4-(dichloromethylidene)cyclopentene
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

5
Patents

351.75082 Da
Monoisotopic Mass

4.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 352.75810 179.9
[M+Na]+ 374.74004 185.1
[M-H]- 350.74354 171.5
[M+NH4]+ 369.78464 191.8
[M+K]+ 390.71398 182.3
[M+H-H2O]+ 334.74808 178.6
[M+HCOO]- 396.74902 162.4
[M+CH3COO]- 410.76467 182.1
[M+Na-2H]- 372.72549 171.9
[M]+ 351.75027 167.7
[M]- 351.75137 167.7
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