CID 137965891

5-(1,3-dioxolan-2-yl)furan-3-sulfonyl chloride

Structural Information

Molecular Formula
C7H7ClO5S
SMILES
C1COC(O1)C2=CC(=CO2)S(=O)(=O)Cl
InChI
InChI=1S/C7H7ClO5S/c8-14(9,10)5-3-6(13-4-5)7-11-1-2-12-7/h3-4,7H,1-2H2
InChIKey
GJTZFFNHUUBIAV-UHFFFAOYSA-N
Compound name
5-(1,3-dioxolan-2-yl)furan-3-sulfonyl chloride
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

237.97028 Da
Monoisotopic Mass

0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 238.97756 146.2
[M+Na]+ 260.95950 156.4
[M-H]- 236.96300 156.0
[M+NH4]+ 256.00410 164.9
[M+K]+ 276.93344 157.4
[M+H-H2O]+ 220.96754 144.2
[M+HCOO]- 282.96848 159.4
[M+CH3COO]- 296.98413 180.6
[M+Na-2H]- 258.94495 150.5
[M]+ 237.96973 153.1
[M]- 237.97083 153.1
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.