CID 22179302

Furan-3-sulfonyl chloride

Structural Information

Molecular Formula
C4H3ClO3S
SMILES
C1=COC=C1S(=O)(=O)Cl
InChI
InChI=1S/C4H3ClO3S/c5-9(6,7)4-1-2-8-3-4/h1-3H
InChIKey
PCBBEIXTVWWTAK-UHFFFAOYSA-N
Compound name
furan-3-sulfonyl chloride
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

173
Patents

165.94914 Da
Monoisotopic Mass

1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 166.95642 126.8
[M+Na]+ 188.93836 138.2
[M-H]- 164.94186 132.4
[M+NH4]+ 183.98296 149.4
[M+K]+ 204.91230 136.6
[M+H-H2O]+ 148.94640 123.8
[M+HCOO]- 210.94734 142.6
[M+CH3COO]- 224.96299 168.8
[M+Na-2H]- 186.92381 133.0
[M]+ 165.94859 132.5
[M]- 165.94969 132.5
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

patents stripe