CID 20330911

2-methoxy-5-sulfamoylbenzene-1-sulfonyl chloride

Structural Information

Molecular Formula
C7H8ClNO5S2
SMILES
COC1=C(C=C(C=C1)S(=O)(=O)N)S(=O)(=O)Cl
InChI
InChI=1S/C7H8ClNO5S2/c1-14-6-3-2-5(16(9,12)13)4-7(6)15(8,10)11/h2-4H,1H3,(H2,9,12,13)
InChIKey
BHYMARKMIWPVIN-UHFFFAOYSA-N
Compound name
2-methoxy-5-sulfamoylbenzenesulfonyl chloride
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

3
Patents

284.95325 Da
Monoisotopic Mass

0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 285.96053 160.9
[M+Na]+ 307.94247 170.3
[M+NH4]+ 302.98707 166.7
[M+K]+ 323.91641 163.5
[M-H]- 283.94597 159.8
[M+Na-2H]- 305.92792 163.9
[M]+ 284.95270 162.9
[M]- 284.95380 162.9
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