CID 3064947

106086-20-8

Structural Information

Molecular Formula

C₁₀H₁₂N₂OS

SMILES

C1C(NC(S1)C2=CC=CC=C2)C(=O)N

InChI

InChI=1S/C10H12N2OS/c11-9(13)8-6-14-10(12-8)7-4-2-1-3-5-7/h1-5,8,10,12H,6H2,(H2,11,13)

InChIKey

WGDMOZRYDFNRMJ-UHFFFAOYSA-N

Compound name

2-phenyl-1,3-thiazolidine-4-carboxamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 2
Patents: 208.06703 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]+	209.07431	144.6
[M+Na]+	231.05625	151.0
[M-H]-	207.05975	148.2
[M+NH4]+	226.10085	163.0
[M+K]+	247.03019	146.8
[M+H-H2O]+	191.06429	138.0
[M+HCOO]-	253.06523	160.2
[M+CH3COO]-	267.08088	181.8
[M+Na-2H]-	229.04170	144.5
[M]+	208.06648	140.2
[M]-	208.06758	140.2

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe