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

146
Patents

121.090294 Da
Monoisotopic Mass

-0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 122.097570 125.1
[M+Na]+ 144.079512 131.6
[M-H]- 120.083018 122.4
[M+NH4]+ 139.124117 146.3
[M+K]+ 160.053452 131.2
[M+H-H2O]+ 104.087554 120.3
[M+HCOO]- 166.088495 144.7
[M+CH3COO]- 180.104145 171.4
[M+Na-2H]- 142.064960 130.0
[M]+ 121.08974542 121.2
[M]- 121.09084258 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