CID 165446323

5-methyloxolane-3-sulfonyl chloride

Structural Information

Molecular Formula
C5H9ClO3S
SMILES
CC1CC(CO1)S(=O)(=O)Cl
InChI
InChI=1S/C5H9ClO3S/c1-4-2-5(3-9-4)10(6,7)8/h4-5H,2-3H2,1H3
InChIKey
BQEQSEDSNOZLBM-UHFFFAOYSA-N
Compound name
5-methyloxolane-3-sulfonyl chloride
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

183.9961 Da
Monoisotopic Mass

0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 185.00338 134.1
[M+Na]+ 206.98532 143.7
[M-H]- 182.98882 139.1
[M+NH4]+ 202.02992 156.1
[M+K]+ 222.95926 142.3
[M+H-H2O]+ 166.99336 131.2
[M+HCOO]- 228.99430 146.6
[M+CH3COO]- 243.00995 173.7
[M+Na-2H]- 204.97077 137.5
[M]+ 183.99555 137.7
[M]- 183.99665 137.7
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.