CID 135413428

2-(cyclopentylamino)-4,5-dihydro-1,3-thiazol-4-one

Structural Information

Molecular Formula

C₈H₁₂N₂OS

SMILES

C1CCC(C1)N=C2NC(=O)CS2

InChI

InChI=1S/C8H12N2OS/c11-7-5-12-8(10-7)9-6-3-1-2-4-6/h6H,1-5H2,(H,9,10,11)

InChIKey

ZJWSRVZPMILSPY-UHFFFAOYSA-N

Compound name

2-cyclopentylimino-1,3-thiazolidin-4-one

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 1
References: 0
Patents: 184.06703 Da
Monoisotopic Mass: 1.4
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]+	185.07431	141.9
[M+Na]+	207.05625	149.2
[M+NH4]+	202.10085	150.4
[M+K]+	223.03019	145.2
[M-H]-	183.05975	144.1
[M+Na-2H]-	205.04170	145.1
[M]+	184.06648	143.5
[M]-	184.06758	143.5

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.