CID 55286423

1-fluoro-3-(methylamino)propan-2-ol

Structural Information

Molecular Formula
C4H10FNO
SMILES
CNCC(CF)O
InChI
InChI=1S/C4H10FNO/c1-6-3-4(7)2-5/h4,6-7H,2-3H2,1H3
InChIKey
DAJBQHSZEOFNOD-UHFFFAOYSA-N
Compound name
1-fluoro-3-(methylamino)propan-2-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

3
Patents

107.07464 Da
Monoisotopic Mass

-0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 108.081916 120.3
[M+Na]+ 130.063858 126.8
[M-H]- 106.067364 118.0
[M+NH4]+ 125.108463 142.3
[M+K]+ 146.037798 126.6
[M+H-H2O]+ 90.071900 115.0
[M+HCOO]- 152.072841 142.4
[M+CH3COO]- 166.088491 168.7
[M+Na-2H]- 128.049306 126.2
[M]+ 107.07409142 117.6
[M]- 107.07518858 117.6
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