CID 155971166

2-(1-aminocyclobutyl)-2,2-difluoroethan-1-ol

Structural Information

Molecular Formula
C6H11F2NO
SMILES
C1CC(C1)(C(CO)(F)F)N
InChI
InChI=1S/C6H11F2NO/c7-6(8,4-10)5(9)2-1-3-5/h10H,1-4,9H2
InChIKey
GVOWUILULGAOBJ-UHFFFAOYSA-N
Compound name
2-(1-aminocyclobutyl)-2,2-difluoroethanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

151.08087 Da
Monoisotopic Mass

0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 152.088146 132.3
[M+Na]+ 174.070088 137.8
[M-H]- 150.073594 131.6
[M+NH4]+ 169.114693 147.6
[M+K]+ 190.044028 139.2
[M+H-H2O]+ 134.078130 122.1
[M+HCOO]- 196.079071 149.8
[M+CH3COO]- 210.094721 177.5
[M+Na-2H]- 172.055536 138.0
[M]+ 151.08032142 134.5
[M]- 151.08141858 134.5
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

No patent data available for this compound.