CID 202246

(s)-1-benzoyl-2-(3-pyridinyl)piperidine

Structural Information

Molecular Formula
C17H18N2O
SMILES
C1CCN([C@@H](C1)C2=CN=CC=C2)C(=O)C3=CC=CC=C3
InChI
InChI=1S/C17H18N2O/c20-17(14-7-2-1-3-8-14)19-12-5-4-10-16(19)15-9-6-11-18-13-15/h1-3,6-9,11,13,16H,4-5,10,12H2/t16-/m0/s1
InChIKey
SPBQHSXFMHGUQF-INIZCTEOSA-N
Compound name
phenyl-[(2S)-2-pyridin-3-ylpiperidin-1-yl]methanone
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

266.1419 Da
Monoisotopic Mass

2.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 267.14918 164.0
[M+Na]+ 289.13112 178.8
[M+NH4]+ 284.17572 172.6
[M+K]+ 305.10506 170.3
[M-H]- 265.13462 169.8
[M+Na-2H]- 287.11657 174.4
[M]+ 266.14135 167.8
[M]- 266.14245 167.8
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.