CID 3046640

62469-44-7

Structural Information

Molecular Formula
C23H30N2O3
SMILES
CN(C)CC(CN1CCOCC1)OC(=O)C(C2=CC=CC=C2)C3=CC=CC=C3
InChI
InChI=1S/C23H30N2O3/c1-24(2)17-21(18-25-13-15-27-16-14-25)28-23(26)22(19-9-5-3-6-10-19)20-11-7-4-8-12-20/h3-12,21-22H,13-18H2,1-2H3
InChIKey
MSHHFYKVFGFXGC-UHFFFAOYSA-N
Compound name
[1-(dimethylamino)-3-morpholin-4-ylpropan-2-yl] 2,2-diphenylacetate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

382.22565 Da
Monoisotopic Mass

3.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 383.23293 195.4
[M+Na]+ 405.21487 194.6
[M-H]- 381.21837 203.1
[M+NH4]+ 400.25947 202.7
[M+K]+ 421.18881 193.6
[M+H-H2O]+ 365.22291 183.8
[M+HCOO]- 427.22385 210.6
[M+CH3COO]- 441.23950 224.0
[M+Na-2H]- 403.20032 195.1
[M]+ 382.22510 193.6
[M]- 382.22620 193.6
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.