CID 215171

35132-82-2

Structural Information

Molecular Formula
C22H29NO2
SMILES
C1CCN(C1)CC(COC(CC2=CC=CC=C2)CC3=CC=CC=C3)O
InChI
InChI=1S/C22H29NO2/c24-21(17-23-13-7-8-14-23)18-25-22(15-19-9-3-1-4-10-19)16-20-11-5-2-6-12-20/h1-6,9-12,21-22,24H,7-8,13-18H2
InChIKey
NYXIJAFDAGNBIH-UHFFFAOYSA-N
Compound name
1-(1,3-diphenylpropan-2-yloxy)-3-pyrrolidin-1-ylpropan-2-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

339.21982 Da
Monoisotopic Mass

4.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 340.227096 185.2
[M+Na]+ 362.209038 186.0
[M-H]- 338.212544 190.2
[M+NH4]+ 357.253643 196.9
[M+K]+ 378.182978 181.3
[M+H-H2O]+ 322.217080 175.2
[M+HCOO]- 384.218021 201.6
[M+CH3COO]- 398.233671 208.0
[M+Na-2H]- 360.194486 183.8
[M]+ 339.21927142 182.4
[M]- 339.22036858 182.4
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.