CID 11970810

Schembl4033263

Structural Information

Molecular Formula
C19H24N2
SMILES
C1CNCCC1(CNCC2=CC=CC=C2)C3=CC=CC=C3
InChI
InChI=1S/C19H24N2/c1-3-7-17(8-4-1)15-21-16-19(11-13-20-14-12-19)18-9-5-2-6-10-18/h1-10,20-21H,11-16H2
InChIKey
VTWWOMAPXUTMCE-UHFFFAOYSA-N
Compound name
1-phenyl-N-[(4-phenylpiperidin-4-yl)methyl]methanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

9
Patents

280.19394 Da
Monoisotopic Mass

3.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 281.201216 168.1
[M+Na]+ 303.183158 170.5
[M-H]- 279.186664 173.3
[M+NH4]+ 298.227763 182.3
[M+K]+ 319.157098 164.4
[M+H-H2O]+ 263.191200 158.2
[M+HCOO]- 325.192141 186.1
[M+CH3COO]- 339.207791 176.9
[M+Na-2H]- 301.168606 174.0
[M]+ 280.19339142 160.1
[M]- 280.19448858 160.1
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