CID 132372756

2172081-57-9

Structural Information

Molecular Formula

C₆H₁₃NO₂S

SMILES

CC1(CCCNS1(=O)=O)C

InChI

InChI=1S/C6H13NO2S/c1-6(2)4-3-5-7-10(6,8)9/h7H,3-5H2,1-2H3

InChIKey

UTBXZTHXGSUBPB-UHFFFAOYSA-N

Compound name

6,6-dimethylthiazinane 1,1-dioxide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 0
Patents: 163.0667 Da
Monoisotopic Mass: 0.4
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]+	164.07398	133.3
[M+Na]+	186.05592	143.3
[M+NH4]+	181.10052	144.0
[M+K]+	202.02986	132.9
[M-H]-	162.05942	133.4
[M+Na-2H]-	184.04137	140.1
[M]+	163.06615	135.3
[M]-	163.06725	135.3

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.