CID 132372808

2172086-82-5

Structural Information

Molecular Formula

SMILES

C1CC12CCNS2(=O)=O

InChI

InChI=1S/C5H9NO2S/c7-9(8)5(1-2-5)3-4-6-9/h6H,1-4H2

InChIKey

QVFDGKZVQNOJAF-UHFFFAOYSA-N

Compound name

4lambda6-thia-5-azaspiro[2.4]heptane 4,4-dioxide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 0
Patents: 147.0354 Da
Monoisotopic Mass: -0.2
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]+	148.04268	135.6
[M+Na]+	170.02462	146.4
[M+NH4]+	165.06922	147.2
[M+K]+	185.99856	139.1
[M-H]-	146.02812	143.1
[M+Na-2H]-	168.01007	144.3
[M]+	147.03485	140.9
[M]-	147.03595	140.9

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.