CID 72075

Bamipine

Structural Information

Molecular Formula
C19H24N2
SMILES
CN1CCC(CC1)N(CC2=CC=CC=C2)C3=CC=CC=C3
InChI
InChI=1S/C19H24N2/c1-20-14-12-19(13-15-20)21(18-10-6-3-7-11-18)16-17-8-4-2-5-9-17/h2-11,19H,12-16H2,1H3
InChIKey
VZSXTYKGYWISGQ-UHFFFAOYSA-N
Compound name
N-benzyl-1-methyl-N-phenylpiperidin-4-amine
Related CIDs

2D Structure

compound 2d structure
7
Annotation Hits

33
References

3212
Patents

280.19394 Da
Monoisotopic Mass

4.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 281.201216 168.0
[M+Na]+ 303.183158 170.8
[M-H]- 279.186664 176.0
[M+NH4]+ 298.227763 181.8
[M+K]+ 319.157098 166.6
[M+H-H2O]+ 263.191200 157.4
[M+HCOO]- 325.192141 187.8
[M+CH3COO]- 339.207791 177.9
[M+Na-2H]- 301.168606 171.8
[M]+ 280.19339142 163.1
[M]- 280.19448858 163.1
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