CID 47002671

N-(2-methylphenyl)piperidin-4-amine

Structural Information

Molecular Formula
C12H18N2
SMILES
CC1=CC=CC=C1NC2CCNCC2
InChI
InChI=1S/C12H18N2/c1-10-4-2-3-5-12(10)14-11-6-8-13-9-7-11/h2-5,11,13-14H,6-9H2,1H3
InChIKey
LADSWAXVIITUMG-UHFFFAOYSA-N
Compound name
N-(2-methylphenyl)piperidin-4-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

17
Patents

190.147 Da
Monoisotopic Mass

2.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 191.15428 144.9
[M+Na]+ 213.13622 156.9
[M+NH4]+ 208.18082 154.1
[M+K]+ 229.11016 149.3
[M-H]- 189.13972 149.5
[M+Na-2H]- 211.12167 152.9
[M]+ 190.14645 147.8
[M]- 190.14755 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

literature stripe

Patent stripe

patents stripe