CID 70080

865-54-3

Structural Information

Molecular Formula
C2H3F5S
SMILES
C=CS(F)(F)(F)(F)F
InChI
InChI=1S/C2H3F5S/c1-2-8(3,4,5,6)7/h2H,1H2
InChIKey
KYXBJPLAQNYNAJ-UHFFFAOYSA-N
Compound name
ethenyl(pentafluoro)-lambda6-sulfane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

9
Patents

153.98756 Da
Monoisotopic Mass

4.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 154.99484 111.1
[M+Na]+ 176.97678 121.7
[M-H]- 152.98028 106.2
[M+NH4]+ 172.02138 132.9
[M+K]+ 192.95072 119.5
[M+H-H2O]+ 136.98482 103.9
[M+HCOO]- 198.98576 124.6
[M+CH3COO]- 213.00141 173.4
[M+Na-2H]- 174.96223 112.8
[M]+ 153.98701 105.5
[M]- 153.98811 105.5
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