CID 49760739

4-(3,5-dimethoxyphenyl)piperidine hydrochloride

Structural Information

Molecular Formula
C13H19NO2
SMILES
COC1=CC(=CC(=C1)C2CCNCC2)OC
InChI
InChI=1S/C13H19NO2/c1-15-12-7-11(8-13(9-12)16-2)10-3-5-14-6-4-10/h7-10,14H,3-6H2,1-2H3
InChIKey
DVWVBNPXZPXCMY-UHFFFAOYSA-N
Compound name
4-(3,5-dimethoxyphenyl)piperidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

11
Patents

221.14159 Da
Monoisotopic Mass

2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 222.148866 151.1
[M+Na]+ 244.130808 156.4
[M-H]- 220.134314 154.4
[M+NH4]+ 239.175413 167.3
[M+K]+ 260.104748 153.4
[M+H-H2O]+ 204.138850 143.3
[M+HCOO]- 266.139791 169.1
[M+CH3COO]- 280.155441 186.4
[M+Na-2H]- 242.116256 154.8
[M]+ 221.14104142 147.8
[M]- 221.14213858 147.8
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