CID 135440923

4-thiazolidinone, 2-((m-chlorophenyl)imino)-

Structural Information

Molecular Formula

C₉H₇ClN₂OS

SMILES

C1C(=O)NC(=NC2=CC(=CC=C2)Cl)S1

InChI

InChI=1S/C9H7ClN2OS/c10-6-2-1-3-7(4-6)11-9-12-8(13)5-14-9/h1-4H,5H2,(H,11,12,13)

InChIKey

HDPOWWWAERDNOX-UHFFFAOYSA-N

Compound name

2-(3-chlorophenyl)imino-1,3-thiazolidin-4-one

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 1
Patents: 225.99677 Da
Monoisotopic Mass: 2.5
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]+	227.00405	146.2
[M+Na]+	248.98599	158.4
[M+NH4]+	244.03059	155.3
[M+K]+	264.95993	150.9
[M-H]-	224.98949	149.8
[M+Na-2H]-	246.97144	152.8
[M]+	225.99622	149.5
[M]-	225.99732	149.5

Literature stripe

literature stripe

Patent stripe

patents stripe