CID 165775216

2751608-22-5

Structural Information

Molecular Formula
C6H13NO2S
SMILES
CS(=N)(=O)CC1CC(C1)O
InChI
InChI=1S/C6H13NO2S/c1-10(7,9)4-5-2-6(8)3-5/h5-8H,2-4H2,1H3
InChIKey
UAVDASOGIMBVNK-UHFFFAOYSA-N
Compound name
3-[(methylsulfonimidoyl)methyl]cyclobutan-1-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

163.0667 Da
Monoisotopic Mass

1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 164.07398 130.8
[M+Na]+ 186.05592 135.5
[M-H]- 162.05942 132.8
[M+NH4]+ 181.10052 144.2
[M+K]+ 202.02986 136.4
[M+H-H2O]+ 146.06396 119.9
[M+HCOO]- 208.06490 145.8
[M+CH3COO]- 222.08055 178.5
[M+Na-2H]- 184.04137 133.6
[M]+ 163.06615 138.2
[M]- 163.06725 138.2
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.