CID 3060330

N-(3-(3-(1-(1-pyrrolidinyl)ethyl)phenoxy)propyl)acetamide

Structural Information

Molecular Formula
C17H26N2O2
SMILES
CC(C1=CC(=CC=C1)OCCCNC(=O)C)N2CCCC2
InChI
InChI=1S/C17H26N2O2/c1-14(19-10-3-4-11-19)16-7-5-8-17(13-16)21-12-6-9-18-15(2)20/h5,7-8,13-14H,3-4,6,9-12H2,1-2H3,(H,18,20)
InChIKey
XOLNOADSUOMGGC-UHFFFAOYSA-N
Compound name
N-[3-[3-(1-pyrrolidin-1-ylethyl)phenoxy]propyl]acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

3
Patents

290.19943 Da
Monoisotopic Mass

2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 291.206706 172.4
[M+Na]+ 313.188648 175.2
[M-H]- 289.192154 176.5
[M+NH4]+ 308.233253 187.6
[M+K]+ 329.162588 172.5
[M+H-H2O]+ 273.196690 163.7
[M+HCOO]- 335.197631 192.0
[M+CH3COO]- 349.213281 204.5
[M+Na-2H]- 311.174096 171.7
[M]+ 290.19888142 171.4
[M]- 290.19997858 171.4
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