CID 22636887

Oxolan-2-ylmethanesulfonyl chloride

Structural Information

Molecular Formula
C5H9ClO3S
SMILES
C1CC(OC1)CS(=O)(=O)Cl
InChI
InChI=1S/C5H9ClO3S/c6-10(7,8)4-5-2-1-3-9-5/h5H,1-4H2
InChIKey
OTZGHNVMPIKAEL-UHFFFAOYSA-N
Compound name
oxolan-2-ylmethanesulfonyl chloride
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

62
Patents

183.9961 Da
Monoisotopic Mass

0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 185.003376 134.9
[M+Na]+ 206.985318 143.6
[M-H]- 182.988824 139.5
[M+NH4]+ 202.029923 156.6
[M+K]+ 222.959258 142.2
[M+H-H2O]+ 166.993360 131.7
[M+HCOO]- 228.994301 147.5
[M+CH3COO]- 243.009951 172.5
[M+Na-2H]- 204.970766 138.8
[M]+ 183.99555142 138.1
[M]- 183.99664858 138.1
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

patents stripe