CID 835134

Benzamide, 4-fluoro-n-(2-(4-morpholinyl)ethyl)-

Structural Information

Molecular Formula

C₁₃H₁₇FN₂O₂

SMILES

C1COCCN1CCNC(=O)C2=CC=C(C=C2)F

InChI

InChI=1S/C13H17FN2O2/c14-12-3-1-11(2-4-12)13(17)15-5-6-16-7-9-18-10-8-16/h1-4H,5-10H2,(H,15,17)

InChIKey

NOMMINDFYOPRPU-UHFFFAOYSA-N

Compound name

4-fluoro-N-(2-morpholin-4-ylethyl)benzamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 5
References: 14
Patents: 252.12741 Da
Monoisotopic Mass: 1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	253.13469	159.2
[M+Na]+	275.11663	169.5
[M+NH4]+	270.16123	166.0
[M+K]+	291.09057	163.5
[M-H]-	251.12013	162.4
[M+Na-2H]-	273.10208	164.6
[M]+	252.12686	161.3
[M]-	252.12796	161.3

Literature stripe

literature stripe

Patent stripe

patents stripe