CID 3077876

Brn 5358687

Structural Information

Molecular Formula
C31H32N2
SMILES
C1C(C(C(N(C1C2=CC=CC=C2)CCC3=CC=CC=C3)C4=CC=CC=C4)C5=CC=CC=C5)N
InChI
InChI=1S/C31H32N2/c32-28-23-29(25-15-7-2-8-16-25)33(22-21-24-13-5-1-6-14-24)31(27-19-11-4-12-20-27)30(28)26-17-9-3-10-18-26/h1-20,28-31H,21-23,32H2
InChIKey
SAVNSLCVTVBUMW-UHFFFAOYSA-N
Compound name
2,3,6-triphenyl-1-(2-phenylethyl)piperidin-4-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

432.25656 Da
Monoisotopic Mass

6.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 433.26384 211.1
[M+Na]+ 455.24578 213.5
[M-H]- 431.24928 222.4
[M+NH4]+ 450.29038 216.8
[M+K]+ 471.21972 204.0
[M+H-H2O]+ 415.25382 196.9
[M+HCOO]- 477.25476 227.4
[M+CH3COO]- 491.27041 217.2
[M+Na-2H]- 453.23123 210.5
[M]+ 432.25601 203.3
[M]- 432.25711 203.3
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

No patent data available for this compound.