CID 2761159

1-(2,6-dimethoxybenzyl)piperidin-4-amine dihydrochloride

Structural Information

Molecular Formula
C14H22N2O2
SMILES
COC1=C(C(=CC=C1)OC)CN2CCC(CC2)N
InChI
InChI=1S/C14H22N2O2/c1-17-13-4-3-5-14(18-2)12(13)10-16-8-6-11(15)7-9-16/h3-5,11H,6-10,15H2,1-2H3
InChIKey
KYCNALWNPRQSMP-UHFFFAOYSA-N
Compound name
1-[(2,6-dimethoxyphenyl)methyl]piperidin-4-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

7
Patents

250.16812 Da
Monoisotopic Mass

1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 251.175396 159.5
[M+Na]+ 273.157338 164.8
[M-H]- 249.160844 163.7
[M+NH4]+ 268.201943 174.9
[M+K]+ 289.131278 162.1
[M+H-H2O]+ 233.165380 151.1
[M+HCOO]- 295.166321 179.0
[M+CH3COO]- 309.181971 197.5
[M+Na-2H]- 271.142786 161.8
[M]+ 250.16757142 157.1
[M]- 250.16866858 157.1
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