CID 24702220

2613383-70-1

Structural Information

Molecular Formula
C13H20N2
SMILES
CN(CC1CCCCN1)C2=CC=CC=C2
InChI
InChI=1S/C13H20N2/c1-15(13-8-3-2-4-9-13)11-12-7-5-6-10-14-12/h2-4,8-9,12,14H,5-7,10-11H2,1H3
InChIKey
IWLZJGQBGKKYCM-UHFFFAOYSA-N
Compound name
N-methyl-N-(piperidin-2-ylmethyl)aniline
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

204.16264 Da
Monoisotopic Mass

2.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 205.16992 148.1
[M+Na]+ 227.15186 150.8
[M-H]- 203.15536 151.9
[M+NH4]+ 222.19646 164.6
[M+K]+ 243.12580 148.0
[M+H-H2O]+ 187.15990 139.6
[M+HCOO]- 249.16084 167.2
[M+CH3COO]- 263.17649 188.4
[M+Na-2H]- 225.13731 152.9
[M]+ 204.16209 141.6
[M]- 204.16319 141.6
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

No patent data available for this compound.