CID 3046641

62469-45-8

Structural Information

Molecular Formula
C25H34N2O3
SMILES
CCN(CC)CC(CN1CCOCC1)OC(=O)C(C2=CC=CC=C2)C3=CC=CC=C3
InChI
InChI=1S/C25H34N2O3/c1-3-26(4-2)19-23(20-27-15-17-29-18-16-27)30-25(28)24(21-11-7-5-8-12-21)22-13-9-6-10-14-22/h5-14,23-24H,3-4,15-20H2,1-2H3
InChIKey
JRVGHLQZYFDFPW-UHFFFAOYSA-N
Compound name
[1-(diethylamino)-3-morpholin-4-ylpropan-2-yl] 2,2-diphenylacetate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

410.25696 Da
Monoisotopic Mass

3.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 411.26424 203.3
[M+Na]+ 433.24618 213.7
[M+NH4]+ 428.29078 209.4
[M+K]+ 449.22012 207.0
[M-H]- 409.24968 209.9
[M+Na-2H]- 431.23163 210.1
[M]+ 410.25641 206.5
[M]- 410.25751 206.5
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.