CID 21644226

2,3,3,3-tetrafluoropropan-1-ol

Structural Information

Molecular Formula
C3H4F4O
SMILES
C(C(C(F)(F)F)F)O
InChI
InChI=1S/C3H4F4O/c4-2(1-8)3(5,6)7/h2,8H,1H2
InChIKey
CAQPTDOAJUMIAI-UHFFFAOYSA-N
Compound name
2,3,3,3-tetrafluoropropan-1-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

170
Patents

132.01982 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 133.027096 118.4
[M+Na]+ 155.009038 126.8
[M-H]- 131.012544 112.6
[M+NH4]+ 150.053643 139.6
[M+K]+ 170.982978 126.1
[M+H-H2O]+ 115.017080 111.6
[M+HCOO]- 177.018021 135.1
[M+CH3COO]- 191.033671 169.2
[M+Na-2H]- 152.994486 123.6
[M]+ 132.01927142 111.7
[M]- 132.02036858 111.7
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