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]+ 339.20671 183.2
[M+Na]+ 361.18865 185.8
[M-H]- 337.19215 191.6
[M+NH4]+ 356.23325 196.4
[M+K]+ 377.16259 182.4
[M+H-H2O]+ 321.19669 172.7
[M+HCOO]- 383.19763 204.2
[M+CH3COO]- 397.21328 214.7
[M+Na-2H]- 359.17410 183.1
[M]+ 338.19888 182.8
[M]- 338.19998 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