CID 22178360

3-amino-2-fluoropropan-1-ol hydrochloride

Structural Information

Molecular Formula
C3H8FNO
SMILES
C(C(CO)F)N
InChI
InChI=1S/C3H8FNO/c4-3(1-5)2-6/h3,6H,1-2,5H2
InChIKey
DTXCSCJRPZOOAQ-UHFFFAOYSA-N
Compound name
3-amino-2-fluoropropan-1-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

80
Patents

93.05899 Da
Monoisotopic Mass

-1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 94.066266 116.1
[M+Na]+ 116.04821 123.0
[M-H]- 92.051714 113.5
[M+NH4]+ 111.09281 138.3
[M+K]+ 132.02215 122.7
[M+H-H2O]+ 76.056250 111.0
[M+HCOO]- 138.05719 137.9
[M+CH3COO]- 152.07284 165.0
[M+Na-2H]- 114.03366 121.4
[M]+ 93.058441 112.0
[M]- 93.059539 112.0
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

patents stripe