CID 3046238

61888-70-8

Structural Information

Molecular Formula

C₁₅H₁₄ClNO₃

SMILES

COC1=CC(=CC(=C1)C2=CC=C(C=C2)Cl)CC(=O)NO

InChI

InChI=1S/C15H14ClNO3/c1-20-14-7-10(8-15(18)17-19)6-12(9-14)11-2-4-13(16)5-3-11/h2-7,9,19H,8H2,1H3,(H,17,18)

InChIKey

ITQAGQKCDVASQC-UHFFFAOYSA-N

Compound name

2-[3-(4-chlorophenyl)-5-methoxyphenyl]-N-hydroxyacetamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 1
References: 0
Patents: 291.06622 Da
Monoisotopic Mass: 2.9
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]+	292.073496	163.4
[M+Na]+	314.055438	171.8
[M-H]-	290.058944	169.2
[M+NH4]+	309.100043	179.1
[M+K]+	330.029378	166.7
[M+H-H2O]+	274.063480	156.9
[M+HCOO]-	336.064421	182.4
[M+CH3COO]-	350.080071	200.2
[M+Na-2H]-	312.040886	167.1
[M]+	291.06567142	166.7
[M]-	291.06676858	166.7

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.