CID 3032899

32595-29-2

Structural Information

Molecular Formula

C₁₁H₁₄N₂S

SMILES

CC1(CN(C(=S)N1)C2=CC=CC=C2)C

InChI

InChI=1S/C11H14N2S/c1-11(2)8-13(10(14)12-11)9-6-4-3-5-7-9/h3-7H,8H2,1-2H3,(H,12,14)

InChIKey

VSWFMNJNVGGNJK-UHFFFAOYSA-N

Compound name

4,4-dimethyl-1-phenylimidazolidine-2-thione

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 1
Patents: 206.08777 Da
Monoisotopic Mass: 2.1
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]+	207.095046	144.1
[M+Na]+	229.076988	153.4
[M-H]-	205.080494	147.4
[M+NH4]+	224.121593	164.5
[M+K]+	245.050928	148.7
[M+H-H2O]+	189.085030	138.0
[M+HCOO]-	251.085971	158.7
[M+CH3COO]-	265.101621	156.6
[M+Na-2H]-	227.062436	145.4
[M]+	206.08722142	142.3
[M]-	206.08831858	142.3

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe