CID 17951321

4-(trifluoromethyl)piperidin-4-ol hydrochloride

Structural Information

Molecular Formula
C6H10F3NO
SMILES
C1CNCCC1(C(F)(F)F)O
InChI
InChI=1S/C6H10F3NO/c7-6(8,9)5(11)1-3-10-4-2-5/h10-11H,1-4H2
InChIKey
AXPLSJSIKGZOMF-UHFFFAOYSA-N
Compound name
4-(trifluoromethyl)piperidin-4-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

446
Patents

169.07144 Da
Monoisotopic Mass

0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 170.07872 133.4
[M+Na]+ 192.06066 139.7
[M-H]- 168.06416 128.5
[M+NH4]+ 187.10526 152.8
[M+K]+ 208.03460 137.2
[M+H-H2O]+ 152.06870 126.3
[M+HCOO]- 214.06964 145.7
[M+CH3COO]- 228.08529 170.3
[M+Na-2H]- 190.04611 139.1
[M]+ 169.07089 122.2
[M]- 169.07199 122.2
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe