CID 10176622

4-(2-hydroxypropan-2-yl)furan-2-sulfonamide

Structural Information

Molecular Formula
C7H11NO4S
SMILES
CC(C)(C1=COC(=C1)S(=O)(=O)N)O
InChI
InChI=1S/C7H11NO4S/c1-7(2,9)5-3-6(12-4-5)13(8,10)11/h3-4,9H,1-2H3,(H2,8,10,11)
InChIKey
RZNNEQHIXCRCKM-UHFFFAOYSA-N
Compound name
4-(2-hydroxypropan-2-yl)furan-2-sulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

142
Patents

205.04088 Da
Monoisotopic Mass

-0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 206.04816 141.3
[M+Na]+ 228.03010 150.1
[M-H]- 204.03360 144.6
[M+NH4]+ 223.07470 160.2
[M+K]+ 244.00404 149.1
[M+H-H2O]+ 188.03814 137.1
[M+HCOO]- 250.03908 158.1
[M+CH3COO]- 264.05473 179.4
[M+Na-2H]- 226.01555 146.3
[M]+ 205.04033 143.9
[M]- 205.04143 143.9
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