CID 102335

2-chloropentafluoropropene

Structural Information

Molecular Formula
C3ClF5
SMILES
C(=C(F)F)(C(F)(F)F)Cl
InChI
InChI=1S/C3ClF5/c4-1(2(5)6)3(7,8)9
InChIKey
YTCHAEAIYHLXBK-UHFFFAOYSA-N
Compound name
2-chloro-1,1,3,3,3-pentafluoroprop-1-ene
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1314
Patents

165.96086 Da
Monoisotopic Mass

2.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 166.96814 118.7
[M+Na]+ 188.95008 128.5
[M-H]- 164.95358 113.1
[M+NH4]+ 183.99468 139.9
[M+K]+ 204.92402 125.5
[M+H-H2O]+ 148.95812 112.0
[M+HCOO]- 210.95906 130.5
[M+CH3COO]- 224.97471 176.1
[M+Na-2H]- 186.93553 122.5
[M]+ 165.96031 111.8
[M]- 165.96141 111.8
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