CID 158293

82979-27-9

Structural Information

Molecular Formula
C5H4Cl4
SMILES
C1CC1(C(=C(Cl)Cl)Cl)Cl
InChI
InChI=1S/C5H4Cl4/c6-3(4(7)8)5(9)1-2-5/h1-2H2
InChIKey
HJQLCRTUOWAVBS-UHFFFAOYSA-N
Compound name
1-chloro-1-(1,2,2-trichloroethenyl)cyclopropane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

7
Patents

203.90671 Da
Monoisotopic Mass

3.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 204.91399 127.5
[M+Na]+ 226.89593 136.5
[M-H]- 202.89943 128.4
[M+NH4]+ 221.94053 143.6
[M+K]+ 242.86987 131.9
[M+H-H2O]+ 186.90397 125.9
[M+HCOO]- 248.90491 130.0
[M+CH3COO]- 262.92056 186.9
[M+Na-2H]- 224.88138 131.0
[M]+ 203.90616 128.7
[M]- 203.90726 128.7
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe