CID 11423751

5-methylfuran-2-sulfonamide

Structural Information

Molecular Formula
C5H7NO3S
SMILES
CC1=CC=C(O1)S(=O)(=O)N
InChI
InChI=1S/C5H7NO3S/c1-4-2-3-5(9-4)10(6,7)8/h2-3H,1H3,(H2,6,7,8)
InChIKey
QFVRGWDWLKEIRP-UHFFFAOYSA-N
Compound name
5-methylfuran-2-sulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

55
Patents

161.01466 Da
Monoisotopic Mass

0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 162.02194 128.7
[M+Na]+ 184.00388 138.9
[M-H]- 160.00738 133.7
[M+NH4]+ 179.04848 150.3
[M+K]+ 199.97782 138.2
[M+H-H2O]+ 144.01192 124.3
[M+HCOO]- 206.01286 149.0
[M+CH3COO]- 220.02851 173.2
[M+Na-2H]- 181.98933 133.8
[M]+ 161.01411 131.6
[M]- 161.01521 131.6
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