CID 1397155

2582-16-3

Structural Information

Molecular Formula

C₇H₁₄N₂S

SMILES

CC1(C(=S)NC(N1)(C)C)C

InChI

InChI=1S/C7H14N2S/c1-6(2)5(10)8-7(3,4)9-6/h9H,1-4H3,(H,8,10)

InChIKey

BOXUTHGPSCJJCG-UHFFFAOYSA-N

Compound name

2,2,5,5-tetramethylimidazolidine-4-thione

Related CIDs

2D Structure

compound 2d structure

2
Annotation Hits: 0
References: 46
Patents: 158.08777 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]+	159.09505	130.4
[M+Na]+	181.07699	140.0
[M-H]-	157.08049	129.3
[M+NH4]+	176.12159	154.2
[M+K]+	197.05093	136.6
[M+H-H2O]+	141.08503	127.0
[M+HCOO]-	203.08597	142.9
[M+CH3COO]-	217.10162	170.9
[M+Na-2H]-	179.06244	132.5
[M]+	158.08722	128.0
[M]-	158.08832	128.0

Literature stripe

literature stripe

Patent stripe

patents stripe