CID 2801741

932-49-0

Structural Information

Molecular Formula

C₅H₁₀N₂OS

SMILES

C1CN(C(=S)N1)CCO

InChI

InChI=1S/C5H10N2OS/c8-4-3-7-2-1-6-5(7)9/h8H,1-4H2,(H,6,9)

InChIKey

AFEITPOSEVENMK-UHFFFAOYSA-N

Compound name

1-(2-hydroxyethyl)imidazolidine-2-thione

Related CIDs

2D Structure

compound 2d structure

2
Annotation Hits: 0
References: 283
Patents: 146.05139 Da
Monoisotopic Mass: -0.8
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]+	147.058666	130.3
[M+Na]+	169.040608	138.1
[M-H]-	145.044114	128.6
[M+NH4]+	164.085213	150.2
[M+K]+	185.014548	135.1
[M+H-H2O]+	129.048650	124.6
[M+HCOO]-	191.049591	143.6
[M+CH3COO]-	205.065241	166.4
[M+Na-2H]-	167.026056	130.8
[M]+	146.05084142	127.3
[M]-	146.05193858	127.3

Literature stripe

literature stripe

Patent stripe

patents stripe