CID 154699546

Ns00117307

Structural Information

Molecular Formula
C20H25N
SMILES
CCC1C(N(CC1(C2=CC=CC=C2)C3=CC=CC=C3)C)C
InChI
InChI=1S/C20H25N/c1-4-19-16(2)21(3)15-20(19,17-11-7-5-8-12-17)18-13-9-6-10-14-18/h5-14,16,19H,4,15H2,1-3H3
InChIKey
DDUXMJACVBEYOX-UHFFFAOYSA-N
Compound name
3-ethyl-1,2-dimethyl-4,4-diphenylpyrrolidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

279.1987 Da
Monoisotopic Mass

5.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 280.20598 168.4
[M+Na]+ 302.18792 175.6
[M-H]- 278.19142 176.8
[M+NH4]+ 297.23252 186.9
[M+K]+ 318.16186 170.1
[M+H-H2O]+ 262.19596 159.8
[M+HCOO]- 324.19690 188.9
[M+CH3COO]- 338.21255 180.1
[M+Na-2H]- 300.17337 169.8
[M]+ 279.19815 166.8
[M]- 279.19925 166.8
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.