CID 90134281

1544241-64-6

Structural Information

Molecular Formula
C5H12FNO
SMILES
CC(C)([C@@H](CN)F)O
InChI
InChI=1S/C5H12FNO/c1-5(2,8)4(6)3-7/h4,8H,3,7H2,1-2H3/t4-/m1/s1
InChIKey
QNFKDKWENVIYDB-SCSAIBSYSA-N
Compound name
(3R)-4-amino-3-fluoro-2-methylbutan-2-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

144
Patents

121.090294 Da
Monoisotopic Mass

-0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 122.09757 125.1
[M+Na]+ 144.07951 131.6
[M-H]- 120.08302 122.4
[M+NH4]+ 139.12412 146.3
[M+K]+ 160.05345 131.2
[M+H-H2O]+ 104.08755 120.3
[M+HCOO]- 166.08850 144.7
[M+CH3COO]- 180.10414 171.4
[M+Na-2H]- 142.06496 130.0
[M]+ 121.08975 121.2
[M]- 121.09084 121.2
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