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]+ 150.058336 126.3
[M+Na]+ 172.040278 131.5
[M-H]- 148.043784 128.5
[M+NH4]+ 167.084883 140.3
[M+K]+ 188.014218 132.6
[M+H-H2O]+ 132.048320 115.6
[M+HCOO]- 194.049261 141.6
[M+CH3COO]- 208.064911 175.5
[M+Na-2H]- 170.025726 129.6
[M]+ 149.05051142 133.3
[M]- 149.05160858 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.