CID 165943620

2703756-12-9

Structural Information

Molecular Formula
C5H11NO2S
SMILES
CS(=N)(=O)C1CC(C1)O
InChI
InChI=1S/C5H11NO2S/c1-9(6,8)5-2-4(7)3-5/h4-7H,2-3H2,1H3
InChIKey
MIHURTSKGKPFAH-UHFFFAOYSA-N
Compound name
3-(methylsulfonimidoyl)cyclobutan-1-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

149.05106 Da
Monoisotopic Mass

0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 150.05834 126.3
[M+Na]+ 172.04028 131.5
[M-H]- 148.04378 128.5
[M+NH4]+ 167.08488 140.3
[M+K]+ 188.01422 132.6
[M+H-H2O]+ 132.04832 115.6
[M+HCOO]- 194.04926 141.6
[M+CH3COO]- 208.06491 175.5
[M+Na-2H]- 170.02573 129.6
[M]+ 149.05051 133.3
[M]- 149.05161 133.3
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.