CID 3064318

Piperidine, 1-(2-(n-methylanilino)ethyl)-, dihydrochloride

Structural Information

Molecular Formula
C14H22N2
SMILES
CN(CCN1CCCCC1)C2=CC=CC=C2
InChI
InChI=1S/C14H22N2/c1-15(14-8-4-2-5-9-14)12-13-16-10-6-3-7-11-16/h2,4-5,8-9H,3,6-7,10-13H2,1H3
InChIKey
YJEMBVGYZLLAEY-UHFFFAOYSA-N
Compound name
N-methyl-N-(2-piperidin-1-ylethyl)aniline
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

5
Patents

218.1783 Da
Monoisotopic Mass

2.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 219.18558 152.4
[M+Na]+ 241.16752 155.1
[M-H]- 217.17102 157.4
[M+NH4]+ 236.21212 169.1
[M+K]+ 257.14146 153.0
[M+H-H2O]+ 201.17556 143.4
[M+HCOO]- 263.17650 172.6
[M+CH3COO]- 277.19215 194.0
[M+Na-2H]- 239.15297 157.1
[M]+ 218.17775 148.1
[M]- 218.17885 148.1
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