CID 16767918

Benzyl-methyl-piperidin-4-ylmethyl-amine

Structural Information

Molecular Formula
C14H22N2
SMILES
CN(CC1CCNCC1)CC2=CC=CC=C2
InChI
InChI=1S/C14H22N2/c1-16(11-13-5-3-2-4-6-13)12-14-7-9-15-10-8-14/h2-6,14-15H,7-12H2,1H3
InChIKey
RKONUTWCBKFEFZ-UHFFFAOYSA-N
Compound name
N-benzyl-N-methyl-1-piperidin-4-ylmethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

15
Patents

218.1783 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 219.18558 152.6
[M+Na]+ 241.16752 154.9
[M-H]- 217.17102 156.2
[M+NH4]+ 236.21212 168.6
[M+K]+ 257.14146 151.8
[M+H-H2O]+ 201.17556 143.9
[M+HCOO]- 263.17650 171.3
[M+CH3COO]- 277.19215 191.4
[M+Na-2H]- 239.15297 156.9
[M]+ 218.17775 146.5
[M]- 218.17885 146.5
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