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

2
Patents

107.07464 Da
Monoisotopic Mass

-0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 108.08192 120.3
[M+Na]+ 130.06386 126.8
[M-H]- 106.06736 118.0
[M+NH4]+ 125.10846 142.3
[M+K]+ 146.03780 126.6
[M+H-H2O]+ 90.071900 115.0
[M+HCOO]- 152.07284 142.4
[M+CH3COO]- 166.08849 168.7
[M+Na-2H]- 128.04931 126.2
[M]+ 107.07409 117.6
[M]- 107.07519 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