CID 209550

3-(1-benzylpyrrolidin-3-yl)-1,1-diphenylurea

Structural Information

Molecular Formula
C24H25N3O
SMILES
C1CN(CC1NC(=O)N(C2=CC=CC=C2)C3=CC=CC=C3)CC4=CC=CC=C4
InChI
InChI=1S/C24H25N3O/c28-24(25-21-16-17-26(19-21)18-20-10-4-1-5-11-20)27(22-12-6-2-7-13-22)23-14-8-3-9-15-23/h1-15,21H,16-19H2,(H,25,28)
InChIKey
DERGOIQEITWKQF-UHFFFAOYSA-N
Compound name
3-(1-benzylpyrrolidin-3-yl)-1,1-diphenylurea
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

371.19977 Da
Monoisotopic Mass

4.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 372.20705 193.4
[M+Na]+ 394.18899 206.2
[M+NH4]+ 389.23359 201.6
[M+K]+ 410.16293 198.9
[M-H]- 370.19249 202.4
[M+Na-2H]- 392.17444 204.9
[M]+ 371.19922 197.7
[M]- 371.20032 197.7
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.

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No patent data available for this compound.