CID 54277083

Schembl1615322

Structural Information

Molecular Formula
C20H25N
SMILES
CCC1C(CC(N1C)C)(C2=CC=CC=C2)C3=CC=CC=C3
InChI
InChI=1S/C20H25N/c1-4-19-20(15-16(2)21(19)3,17-11-7-5-8-12-17)18-13-9-6-10-14-18/h5-14,16,19H,4,15H2,1-3H3
InChIKey
RODQCWPQPPLNGP-UHFFFAOYSA-N
Compound name
2-ethyl-1,5-dimethyl-3,3-diphenylpyrrolidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

23
Patents

279.1987 Da
Monoisotopic Mass

5.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 280.20598 169.9
[M+Na]+ 302.18792 184.9
[M+NH4]+ 297.23252 181.1
[M+K]+ 318.16186 175.1
[M-H]- 278.19142 176.7
[M+Na-2H]- 300.17337 180.9
[M]+ 279.19815 174.4
[M]- 279.19925 174.4
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