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]+ 238.977556 146.2
[M+Na]+ 260.959498 156.4
[M-H]- 236.963004 156.0
[M+NH4]+ 256.004103 164.9
[M+K]+ 276.933438 157.4
[M+H-H2O]+ 220.967540 144.2
[M+HCOO]- 282.968481 159.4
[M+CH3COO]- 296.984131 180.6
[M+Na-2H]- 258.944946 150.5
[M]+ 237.96973142 153.1
[M]- 237.97082858 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.