CID 105466435

2-cyclobutyl-2-methoxyethane-1-sulfonyl chloride

Structural Information

Molecular Formula
C7H13ClO3S
SMILES
COC(CS(=O)(=O)Cl)C1CCC1
InChI
InChI=1S/C7H13ClO3S/c1-11-7(5-12(8,9)10)6-3-2-4-6/h6-7H,2-5H2,1H3
InChIKey
UVPJXGJDCPLPNN-UHFFFAOYSA-N
Compound name
2-cyclobutyl-2-methoxyethanesulfonyl chloride
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

212.02739 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 213.034666 134.6
[M+Na]+ 235.016608 140.1
[M-H]- 211.020114 137.9
[M+NH4]+ 230.061213 147.9
[M+K]+ 250.990548 140.8
[M+H-H2O]+ 195.024650 125.1
[M+HCOO]- 257.025591 145.3
[M+CH3COO]- 271.041241 184.6
[M+Na-2H]- 233.002056 137.1
[M]+ 212.02684142 147.4
[M]- 212.02793858 147.4
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.