CID 76685198

Cimlanod

Structural Information

Molecular Formula
C5H7NO4S
SMILES
CC1=CC=C(O1)S(=O)(=O)NO
InChI
InChI=1S/C5H7NO4S/c1-4-2-3-5(10-4)11(8,9)6-7/h2-3,6-7H,1H3
InChIKey
LIXKIXWSKOENAB-UHFFFAOYSA-N
Compound name
N-hydroxy-5-methylfuran-2-sulfonamide
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

83
Patents

177.00958 Da
Monoisotopic Mass

0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 178.016856 131.8
[M+Na]+ 199.998798 141.2
[M-H]- 176.002304 135.8
[M+NH4]+ 195.043403 152.1
[M+K]+ 215.972738 140.5
[M+H-H2O]+ 160.006840 127.3
[M+HCOO]- 222.007781 151.4
[M+CH3COO]- 236.023431 173.5
[M+Na-2H]- 197.984246 137.6
[M]+ 177.00903142 135.2
[M]- 177.01012858 135.2
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe