CID 25323227

2-chloro-n-[2-(2-methoxyphenoxy)ethyl]acetamide

Structural Information

Molecular Formula

C₁₁H₁₄ClNO₃

SMILES

COC1=CC=CC=C1OCCNC(=O)CCl

InChI

InChI=1S/C11H14ClNO3/c1-15-9-4-2-3-5-10(9)16-7-6-13-11(14)8-12/h2-5H,6-8H2,1H3,(H,13,14)

InChIKey

KNVHMXSCCDHSLU-UHFFFAOYSA-N

Compound name

2-chloro-N-[2-(2-methoxyphenoxy)ethyl]acetamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 9
Patents: 243.06622 Da
Monoisotopic Mass: 1.8
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]+	244.073496	151.4
[M+Na]+	266.055438	158.7
[M-H]-	242.058944	154.8
[M+NH4]+	261.100043	169.5
[M+K]+	282.029378	155.7
[M+H-H2O]+	226.063480	145.7
[M+HCOO]-	288.064421	171.7
[M+CH3COO]-	302.080071	192.5
[M+Na-2H]-	264.040886	156.4
[M]+	243.06567142	156.6
[M]-	243.06676858	156.6

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe