CID 13493128

91818-96-1

Structural Information

Molecular Formula

C₁₀H₁₃NO₂S

SMILES

C1CN(S(=O)(=O)C1)CC2=CC=CC=C2

InChI

InChI=1S/C10H13NO2S/c12-14(13)8-4-7-11(14)9-10-5-2-1-3-6-10/h1-3,5-6H,4,7-9H2

InChIKey

TZKMAPDWYRGEOB-UHFFFAOYSA-N

Compound name

2-benzyl-1,2-thiazolidine 1,1-dioxide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 1
Patents: 211.0667 Da
Monoisotopic Mass: 1.1
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]+	212.07398	145.0
[M+Na]+	234.05592	156.7
[M+NH4]+	229.10052	155.1
[M+K]+	250.02986	148.1
[M-H]-	210.05942	147.7
[M+Na-2H]-	232.04137	152.9
[M]+	211.06615	148.0
[M]-	211.06725	148.0

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe