CID 3061846

79820-10-3

Structural Information

Molecular Formula
C26H29NO
SMILES
C1CC(N(C1)CC2=CC=CC=C2)C(CC3=CC=CC=C3)(CC4=CC=CC=C4)O
InChI
InChI=1S/C26H29NO/c28-26(19-22-11-4-1-5-12-22,20-23-13-6-2-7-14-23)25-17-10-18-27(25)21-24-15-8-3-9-16-24/h1-9,11-16,25,28H,10,17-21H2
InChIKey
PEWPXEKMEQYRRJ-UHFFFAOYSA-N
Compound name
2-(1-benzylpyrrolidin-2-yl)-1,3-diphenylpropan-2-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

371.2249 Da
Monoisotopic Mass

5.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 372.23218 192.8
[M+Na]+ 394.21412 195.3
[M-H]- 370.21762 201.2
[M+NH4]+ 389.25872 203.2
[M+K]+ 410.18806 188.0
[M+H-H2O]+ 354.22216 182.1
[M+HCOO]- 416.22310 209.2
[M+CH3COO]- 430.23875 200.6
[M+Na-2H]- 392.19957 193.9
[M]+ 371.22435 188.3
[M]- 371.22545 188.3
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.