CID 62541784

4-[4-(trifluoromethyl)-1,3-thiazol-2-yl]piperidine

Structural Information

Molecular Formula
C9H11F3N2S
SMILES
C1CNCCC1C2=NC(=CS2)C(F)(F)F
InChI
InChI=1S/C9H11F3N2S/c10-9(11,12)7-5-15-8(14-7)6-1-3-13-4-2-6/h5-6,13H,1-4H2
InChIKey
LESCGCCPEGZDKA-UHFFFAOYSA-N
Compound name
2-piperidin-4-yl-4-(trifluoromethyl)-1,3-thiazole
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

236.05951 Da
Monoisotopic Mass

2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 237.06679 152.1
[M+Na]+ 259.04873 159.2
[M+NH4]+ 254.09333 158.0
[M+K]+ 275.02267 154.1
[M-H]- 235.05223 149.4
[M+Na-2H]- 257.03418 155.0
[M]+ 236.05896 152.3
[M]- 236.06006 152.3
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.