CID 145912916

2378503-40-1

Structural Information

Molecular Formula
C8H15NO2S
SMILES
CS(=O)(=O)C1CC2(C1)CCNC2
InChI
InChI=1S/C8H15NO2S/c1-12(10,11)7-4-8(5-7)2-3-9-6-8/h7,9H,2-6H2,1H3
InChIKey
BADZYLOLQVAERU-UHFFFAOYSA-N
Compound name
2-methylsulfonyl-6-azaspiro[3.4]octane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

189.08235 Da
Monoisotopic Mass

0.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 190.089626 136.3
[M+Na]+ 212.071568 141.5
[M-H]- 188.075074 138.9
[M+NH4]+ 207.116173 151.7
[M+K]+ 228.045508 142.1
[M+H-H2O]+ 172.079610 126.9
[M+HCOO]- 234.080551 148.5
[M+CH3COO]- 248.096201 177.4
[M+Na-2H]- 210.057016 139.3
[M]+ 189.08180142 142.5
[M]- 189.08289858 142.5
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.