CID 226102

4-benzoylpiperidine hydrochloride

Structural Information

Molecular Formula
C12H15NO
SMILES
C1CNCCC1C(=O)C2=CC=CC=C2
InChI
InChI=1S/C12H15NO/c14-12(10-4-2-1-3-5-10)11-6-8-13-9-7-11/h1-5,11,13H,6-9H2
InChIKey
DDRCHUGHUHZNKZ-UHFFFAOYSA-N
Compound name
phenyl(piperidin-4-yl)methanone
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

4
References

1033
Patents

189.11537 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 190.12265 142.7
[M+Na]+ 212.10459 146.6
[M-H]- 188.10809 145.4
[M+NH4]+ 207.14919 159.4
[M+K]+ 228.07853 143.1
[M+H-H2O]+ 172.11263 135.0
[M+HCOO]- 234.11357 160.0
[M+CH3COO]- 248.12922 179.1
[M+Na-2H]- 210.09004 147.2
[M]+ 189.11482 135.4
[M]- 189.11592 135.4
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