CID 202861

Propiophenone, 4'-chloro-2-methyl-2-piperidino-, hydrochloride

Structural Information

Molecular Formula
C15H20ClNO
SMILES
CC(C)(C(=O)C1=CC=C(C=C1)Cl)N2CCCCC2
InChI
InChI=1S/C15H20ClNO/c1-15(2,17-10-4-3-5-11-17)14(18)12-6-8-13(16)9-7-12/h6-9H,3-5,10-11H2,1-2H3
InChIKey
DQJYLDLGSGDMQM-UHFFFAOYSA-N
Compound name
1-(4-chlorophenyl)-2-methyl-2-piperidin-1-ylpropan-1-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

6
Patents

265.12335 Da
Monoisotopic Mass

3.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 266.13063 161.5
[M+Na]+ 288.11257 166.7
[M-H]- 264.11607 165.6
[M+NH4]+ 283.15717 177.1
[M+K]+ 304.08651 162.1
[M+H-H2O]+ 248.12061 154.3
[M+HCOO]- 310.12155 173.1
[M+CH3COO]- 324.13720 195.9
[M+Na-2H]- 286.09802 164.4
[M]+ 265.12280 159.3
[M]- 265.12390 159.3
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

patents stripe