CID 44767

Dpx-8

Structural Information

Molecular Formula
C21H26N2O3
SMILES
C1CCN(CC1)NCCOC(=O)C(C2=CC=CC=C2)(C3=CC=CC=C3)O
InChI
InChI=1S/C21H26N2O3/c24-20(26-17-14-22-23-15-8-3-9-16-23)21(25,18-10-4-1-5-11-18)19-12-6-2-7-13-19/h1-2,4-7,10-13,22,25H,3,8-9,14-17H2
InChIKey
HVADSRWSDNYDQA-UHFFFAOYSA-N
Compound name
2-(piperidin-1-ylamino)ethyl 2-hydroxy-2,2-diphenylacetate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

354.19434 Da
Monoisotopic Mass

3.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 355.201616 184.1
[M+Na]+ 377.183558 184.5
[M-H]- 353.187064 188.9
[M+NH4]+ 372.228163 192.9
[M+K]+ 393.157498 180.2
[M+H-H2O]+ 337.191600 173.8
[M+HCOO]- 399.192541 199.4
[M+CH3COO]- 413.208191 211.1
[M+Na-2H]- 375.169006 188.0
[M]+ 354.19379142 178.8
[M]- 354.19488858 178.8
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.