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]+ 213.03467 140.5
[M+Na]+ 235.01661 149.9
[M-H]- 211.02011 145.3
[M+NH4]+ 230.06121 163.3
[M+K]+ 250.99055 148.3
[M+H-H2O]+ 195.02465 138.4
[M+HCOO]- 257.02559 152.4
[M+CH3COO]- 271.04124 179.2
[M+Na-2H]- 233.00206 144.7
[M]+ 212.02684 145.2
[M]- 212.02794 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.