CID 210865

N-(1-(2-phenoxyethyl)-3-pyrrolidinyl)propionanilide hydrochloride

Structural Information

Molecular Formula
C21H26N2O2
SMILES
CCC(=O)N(C1CCN(C1)CCOC2=CC=CC=C2)C3=CC=CC=C3
InChI
InChI=1S/C21H26N2O2/c1-2-21(24)23(18-9-5-3-6-10-18)19-13-14-22(17-19)15-16-25-20-11-7-4-8-12-20/h3-12,19H,2,13-17H2,1H3
InChIKey
SYAPVVKVRRVMNI-UHFFFAOYSA-N
Compound name
N-[1-(2-phenoxyethyl)pyrrolidin-3-yl]-N-phenylpropanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

338.19943 Da
Monoisotopic Mass

3.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 339.206706 183.2
[M+Na]+ 361.188648 185.8
[M-H]- 337.192154 191.6
[M+NH4]+ 356.233253 196.4
[M+K]+ 377.162588 182.4
[M+H-H2O]+ 321.196690 172.7
[M+HCOO]- 383.197631 204.2
[M+CH3COO]- 397.213281 214.7
[M+Na-2H]- 359.174096 183.1
[M]+ 338.19888142 182.8
[M]- 338.19997858 182.8
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

patents stripe