CID 126970912

5,5-dimethyloxolane-3-sulfonyl chloride

Structural Information

Molecular Formula
C6H11ClO3S
SMILES
CC1(CC(CO1)S(=O)(=O)Cl)C
InChI
InChI=1S/C6H11ClO3S/c1-6(2)3-5(4-10-6)11(7,8)9/h5H,3-4H2,1-2H3
InChIKey
VCORSXQABVZEKQ-UHFFFAOYSA-N
Compound name
5,5-dimethyloxolane-3-sulfonyl chloride
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

198.01175 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 199.019026 135.9
[M+Na]+ 221.000968 145.8
[M-H]- 197.004474 140.9
[M+NH4]+ 216.045573 159.3
[M+K]+ 236.974908 144.4
[M+H-H2O]+ 181.009010 134.0
[M+HCOO]- 243.009951 148.2
[M+CH3COO]- 257.025601 176.2
[M+Na-2H]- 218.986416 140.6
[M]+ 198.01120142 140.3
[M]- 198.01229858 140.3
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.