CID 6373

Trifluoromethane

Structural Information

Molecular Formula
CHF3
SMILES
C(F)(F)F
InChI
InChI=1S/CHF3/c2-1(3)4/h1H
InChIKey
XPDWGBQVDMORPB-UHFFFAOYSA-N
Compound name
fluoroform
Related CIDs

2D Structure

compound 2d structure
7
Annotation Hits

730
References

244905
Patents

70.00304 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 71.010316 102.5
[M+Na]+ 92.992258 111.5
[M-H]- 68.995764 99.6
[M+NH4]+ 88.036863 126.8
[M+K]+ 108.96620 112.1
[M+H-H2O]+ 53.000300 96.5
[M+HCOO]- 115.00124 123.7
[M+CH3COO]- 129.01689 161.5
[M+Na-2H]- 90.977706 109.5
[M]+ 70.002491 97.5
[M]- 70.003589 97.5
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.