CID 13476550

(2-chlorophenyl)(piperidin-4-yl)methanone hydrochloride

Structural Information

Molecular Formula
C12H14ClNO
SMILES
C1CNCCC1C(=O)C2=CC=CC=C2Cl
InChI
InChI=1S/C12H14ClNO/c13-11-4-2-1-3-10(11)12(15)9-5-7-14-8-6-9/h1-4,9,14H,5-8H2
InChIKey
BTRYGLDUFBMBSD-UHFFFAOYSA-N
Compound name
(2-chlorophenyl)-piperidin-4-ylmethanone
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

41
Patents

223.07639 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 224.08367 148.7
[M+Na]+ 246.06561 162.0
[M+NH4]+ 241.11021 157.7
[M+K]+ 262.03955 154.4
[M-H]- 222.06911 152.1
[M+Na-2H]- 244.05106 156.2
[M]+ 223.07584 151.8
[M]- 223.07694 151.8
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

patents stripe