CID 89642

1-methyl-n-phenylpiperidin-4-amine

Structural Information

Molecular Formula
C12H18N2
SMILES
CN1CCC(CC1)NC2=CC=CC=C2
InChI
InChI=1S/C12H18N2/c1-14-9-7-12(8-10-14)13-11-5-3-2-4-6-11/h2-6,12-13H,7-10H2,1H3
InChIKey
GXJSWUKLJQHQFZ-UHFFFAOYSA-N
Compound name
1-methyl-N-phenylpiperidin-4-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

152
Patents

190.147 Da
Monoisotopic Mass

2.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 191.15428 143.3
[M+Na]+ 213.13622 147.8
[M-H]- 189.13972 147.6
[M+NH4]+ 208.18082 160.9
[M+K]+ 229.11016 144.7
[M+H-H2O]+ 173.14426 135.2
[M+HCOO]- 235.14520 163.8
[M+CH3COO]- 249.16085 185.6
[M+Na-2H]- 211.12167 149.2
[M]+ 190.14645 137.5
[M]- 190.14755 137.5
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