CID 209226

Brn 0497798

Structural Information

Molecular Formula
C24H25N3O
SMILES
CN(C1CCN(C1)C(=O)N(C2=CC=CC=C2)C3=CC=CC=C3)C4=CC=CC=C4
InChI
InChI=1S/C24H25N3O/c1-25(20-11-5-2-6-12-20)23-17-18-26(19-23)24(28)27(21-13-7-3-8-14-21)22-15-9-4-10-16-22/h2-16,23H,17-19H2,1H3
InChIKey
SWQVNCDCXATWGJ-UHFFFAOYSA-N
Compound name
3-(N-methylanilino)-N,N-diphenylpyrrolidine-1-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

371.19977 Da
Monoisotopic Mass

4.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 372.207046 190.0
[M+Na]+ 394.188988 191.7
[M-H]- 370.192494 202.7
[M+NH4]+ 389.233593 201.4
[M+K]+ 410.162928 188.0
[M+H-H2O]+ 354.197030 178.0
[M+HCOO]- 416.197971 212.4
[M+CH3COO]- 430.213621 199.1
[M+Na-2H]- 392.174436 190.5
[M]+ 371.19922142 186.9
[M]- 371.20031858 186.9
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