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

122
Patents

205.04088 Da
Monoisotopic Mass

-0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 206.048156 141.3
[M+Na]+ 228.030098 150.1
[M-H]- 204.033604 144.6
[M+NH4]+ 223.074703 160.2
[M+K]+ 244.004038 149.1
[M+H-H2O]+ 188.038140 137.1
[M+HCOO]- 250.039081 158.1
[M+CH3COO]- 264.054731 179.4
[M+Na-2H]- 226.015546 146.3
[M]+ 205.04033142 143.9
[M]- 205.04142858 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