CID 596718

41804-89-1

Structural Information

Molecular Formula
CHF3O2S
SMILES
C(F)(F)(F)S(=O)O
InChI
InChI=1S/CHF3O2S/c2-1(3,4)7(5)6/h(H,5,6)
InChIKey
SFEBPWPPVGRFOA-UHFFFAOYSA-N
Compound name
trifluoromethanesulfinic acid
Related CIDs

2D Structure

compound 2d structure
4
Annotation Hits

11
References

1643
Patents

133.96494 Da
Monoisotopic Mass

0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 134.97222 126.8
[M+Na]+ 156.95416 133.2
[M+NH4]+ 151.99876 132.1
[M+K]+ 172.92810 128.9
[M-H]- 132.95766 120.7
[M+Na-2H]- 154.93961 127.4
[M]+ 133.96439 125.9
[M]- 133.96549 125.9
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