CID 65445633

2-(2,3-dihydro-1-benzofuran-5-yl)ethane-1-sulfonamide

Structural Information

Molecular Formula
C10H13NO3S
SMILES
C1COC2=C1C=C(C=C2)CCS(=O)(=O)N
InChI
InChI=1S/C10H13NO3S/c11-15(12,13)6-4-8-1-2-10-9(7-8)3-5-14-10/h1-2,7H,3-6H2,(H2,11,12,13)
InChIKey
UTDLQOSVRLWDPD-UHFFFAOYSA-N
Compound name
2-(2,3-dihydro-1-benzofuran-5-yl)ethanesulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

227.06161 Da
Monoisotopic Mass

0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 228.06889 146.9
[M+Na]+ 250.05083 155.4
[M-H]- 226.05433 151.8
[M+NH4]+ 245.09543 166.8
[M+K]+ 266.02477 153.4
[M+H-H2O]+ 210.05887 142.2
[M+HCOO]- 272.05981 164.3
[M+CH3COO]- 286.07546 186.1
[M+Na-2H]- 248.03628 152.1
[M]+ 227.06106 149.4
[M]- 227.06216 149.4
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

No patent data available for this compound.