CID 146155546

2,2-difluoro-2-(piperidin-2-yl)ethan-1-ol

Structural Information

Molecular Formula
C7H13F2NO
SMILES
C1CCNC(C1)C(CO)(F)F
InChI
InChI=1S/C7H13F2NO/c8-7(9,5-11)6-3-1-2-4-10-6/h6,10-11H,1-5H2
InChIKey
TXLKHMPALQPCIO-UHFFFAOYSA-N
Compound name
2,2-difluoro-2-piperidin-2-ylethanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

165.09653 Da
Monoisotopic Mass

0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 166.103806 135.1
[M+Na]+ 188.085748 139.8
[M-H]- 164.089254 130.9
[M+NH4]+ 183.130353 152.6
[M+K]+ 204.059688 137.2
[M+H-H2O]+ 148.093790 127.9
[M+HCOO]- 210.094731 148.1
[M+CH3COO]- 224.110381 171.5
[M+Na-2H]- 186.071196 139.7
[M]+ 165.09598142 125.2
[M]- 165.09707858 125.2
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

No patent data available for this compound.