CID 30555

Mercury, bis(trifluoromethylthio)-

Structural Information

Molecular Formula
CHF3S
SMILES
C(F)(F)(F)S
InChI
InChI=1S/CHF3S/c2-1(3,4)5/h5H
InChIKey
MFLLMKMFWIUACU-UHFFFAOYSA-N
Compound name
trifluoromethanethiol
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

5
References

24056
Patents

101.975105 Da
Monoisotopic Mass

1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 102.98238 108.0
[M+Na]+ 124.96432 117.7
[M-H]- 100.96783 105.4
[M+NH4]+ 120.00893 131.7
[M+K]+ 140.93826 117.1
[M+H-H2O]+ 84.972365 101.9
[M+HCOO]- 146.97331 123.2
[M+CH3COO]- 160.98896 164.9
[M+Na-2H]- 122.94977 112.9
[M]+ 101.97456 105.3
[M]- 101.97565 105.3
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