CID 130757865

2-(oxan-3-yl)ethane-1-sulfonyl chloride

Structural Information

Molecular Formula
C7H13ClO3S
SMILES
C1CC(COC1)CCS(=O)(=O)Cl
InChI
InChI=1S/C7H13ClO3S/c8-12(9,10)5-3-7-2-1-4-11-6-7/h7H,1-6H2
InChIKey
NVTPDZBZTJLKSZ-UHFFFAOYSA-N
Compound name
2-(oxan-3-yl)ethanesulfonyl chloride
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

212.02739 Da
Monoisotopic Mass

1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 213.03467 142.8
[M+Na]+ 235.01661 153.2
[M+NH4]+ 230.06121 151.0
[M+K]+ 250.99055 146.1
[M-H]- 211.02011 144.5
[M+Na-2H]- 233.00206 146.3
[M]+ 212.02684 145.3
[M]- 212.02794 145.3
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.