CID 3058932

2-(m-tolyl)thiazolidine

Structural Information

Molecular Formula

C₁₀H₁₃NS

SMILES

CC1=CC(=CC=C1)C2NCCS2

InChI

InChI=1S/C10H13NS/c1-8-3-2-4-9(7-8)10-11-5-6-12-10/h2-4,7,10-11H,5-6H2,1H3

InChIKey

XGRWDOHURTVHMY-UHFFFAOYSA-N

Compound name

2-(3-methylphenyl)-1,3-thiazolidine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 2
Patents: 179.07687 Da
Monoisotopic Mass: 1.8
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]+	180.08415	138.1
[M+Na]+	202.06609	150.1
[M+NH4]+	197.11069	148.2
[M+K]+	218.04003	142.7
[M-H]-	178.06959	142.0
[M+Na-2H]-	200.05154	145.0
[M]+	179.07632	141.4
[M]-	179.07742	141.4

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe