CID 410840

N-benzyl-alpha-phenylphenethylamine

Structural Information

Molecular Formula
C21H21N
SMILES
C1=CC=C(C=C1)CC(C2=CC=CC=C2)NCC3=CC=CC=C3
InChI
InChI=1S/C21H21N/c1-4-10-18(11-5-1)16-21(20-14-8-3-9-15-20)22-17-19-12-6-2-7-13-19/h1-15,21-22H,16-17H2
InChIKey
LUPHIKYFQYDIDI-UHFFFAOYSA-N
Compound name
N-benzyl-1,2-diphenylethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

287.1674 Da
Monoisotopic Mass

4.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 288.17468 172.6
[M+Na]+ 310.15662 188.5
[M+NH4]+ 305.20122 182.6
[M+K]+ 326.13056 177.6
[M-H]- 286.16012 181.4
[M+Na-2H]- 308.14207 185.8
[M]+ 287.16685 177.6
[M]- 287.16795 177.6
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

No patent data available for this compound.