CID 2947746

326610-71-3

Structural Information

Molecular Formula
C11H12N2O3S
SMILES
C1=CC(=CC(=C1)S(=O)(=O)NCC2=CC=CO2)N
InChI
InChI=1S/C11H12N2O3S/c12-9-3-1-5-11(7-9)17(14,15)13-8-10-4-2-6-16-10/h1-7,13H,8,12H2
InChIKey
HGEBFZLOXJIJHK-UHFFFAOYSA-N
Compound name
3-amino-N-(furan-2-ylmethyl)benzenesulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

252.05687 Da
Monoisotopic Mass

0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 253.064146 153.2
[M+Na]+ 275.046088 161.4
[M-H]- 251.049594 160.8
[M+NH4]+ 270.090693 170.3
[M+K]+ 291.020028 158.6
[M+H-H2O]+ 235.054130 146.7
[M+HCOO]- 297.055071 174.3
[M+CH3COO]- 311.070721 192.2
[M+Na-2H]- 273.031536 158.5
[M]+ 252.05632142 155.2
[M]- 252.05741858 155.2
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.