CID 126970897

(4,4-dimethyloxolan-2-yl)methanesulfonyl chloride

Structural Information

Molecular Formula
C7H13ClO3S
SMILES
CC1(CC(OC1)CS(=O)(=O)Cl)C
InChI
InChI=1S/C7H13ClO3S/c1-7(2)3-6(11-5-7)4-12(8,9)10/h6H,3-5H2,1-2H3
InChIKey
NOTCUCGOSSWGKT-UHFFFAOYSA-N
Compound name
(4,4-dimethyloxolan-2-yl)methanesulfonyl 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 140.5
[M+Na]+ 235.016608 149.9
[M-H]- 211.020114 145.3
[M+NH4]+ 230.061213 163.3
[M+K]+ 250.990548 148.3
[M+H-H2O]+ 195.024650 138.4
[M+HCOO]- 257.025591 152.4
[M+CH3COO]- 271.041241 179.2
[M+Na-2H]- 233.002056 144.7
[M]+ 212.02684142 145.2
[M]- 212.02793858 145.2
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.