CID 3053874

Anc-31

Structural Information

Molecular Formula
C20H24N2O3
SMILES
C1CCN(C1)NCCOC(=O)C(C2=CC=CC=C2)(C3=CC=CC=C3)O
InChI
InChI=1S/C20H24N2O3/c23-19(25-16-13-21-22-14-7-8-15-22)20(24,17-9-3-1-4-10-17)18-11-5-2-6-12-18/h1-6,9-12,21,24H,7-8,13-16H2
InChIKey
ZNLXTRGHUFIDJL-UHFFFAOYSA-N
Compound name
2-(pyrrolidin-1-ylamino)ethyl 2-hydroxy-2,2-diphenylacetate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

340.17868 Da
Monoisotopic Mass

2.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 341.185956 180.1
[M+Na]+ 363.167898 181.9
[M-H]- 339.171404 185.8
[M+NH4]+ 358.212503 191.6
[M+K]+ 379.141838 177.8
[M+H-H2O]+ 323.175940 170.7
[M+HCOO]- 385.176881 198.1
[M+CH3COO]- 399.192531 207.4
[M+Na-2H]- 361.153346 182.9
[M]+ 340.17813142 176.8
[M]- 340.17922858 176.8
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.