CID 122163179

2-(prop-2-en-1-yloxy)ethane-1-sulfonyl chloride

Structural Information

Molecular Formula
C5H9ClO3S
SMILES
C=CCOCCS(=O)(=O)Cl
InChI
InChI=1S/C5H9ClO3S/c1-2-3-9-4-5-10(6,7)8/h2H,1,3-5H2
InChIKey
ZEQIEESPCKOAQQ-UHFFFAOYSA-N
Compound name
2-prop-2-enoxyethanesulfonyl 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 133.0
[M+Na]+ 206.98532 142.3
[M-H]- 182.98882 134.0
[M+NH4]+ 202.02992 154.3
[M+K]+ 222.95926 139.1
[M+H-H2O]+ 166.99336 129.8
[M+HCOO]- 228.99430 147.0
[M+CH3COO]- 243.00995 175.5
[M+Na-2H]- 204.97077 137.4
[M]+ 183.99555 139.3
[M]- 183.99665 139.3
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.