CID 3075564

1-methyl-5-phenyl-2-imidazolidinethione

Structural Information

Molecular Formula

C₁₀H₁₂N₂S

SMILES

CN1C(CNC1=S)C2=CC=CC=C2

InChI

InChI=1S/C10H12N2S/c1-12-9(7-11-10(12)13)8-5-3-2-4-6-8/h2-6,9H,7H2,1H3,(H,11,13)

InChIKey

ZFOUTMOBRSLFAR-UHFFFAOYSA-N

Compound name

1-methyl-5-phenylimidazolidine-2-thione

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 11
Patents: 192.07211 Da
Monoisotopic Mass: 1.5
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]+	193.07939	142.3
[M+Na]+	215.06133	154.5
[M+NH4]+	210.10593	151.2
[M+K]+	231.03527	147.3
[M-H]-	191.06483	145.1
[M+Na-2H]-	213.04678	148.3
[M]+	192.07156	145.2
[M]-	192.07266	145.2

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe