CID 200818

2776-47-8

Structural Information

Molecular Formula
C9H9N3O3S
SMILES
C1=CC(=CC=C1N)S(=O)(=O)NC2=NOC=C2
InChI
InChI=1S/C9H9N3O3S/c10-7-1-3-8(4-2-7)16(13,14)12-9-5-6-15-11-9/h1-6H,10H2,(H,11,12)
InChIKey
GKOXIKLCHCEONU-UHFFFAOYSA-N
Compound name
4-amino-N-(1,2-oxazol-3-yl)benzenesulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

9
Patents

239.03647 Da
Monoisotopic Mass

0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 240.04375 149.2
[M+Na]+ 262.02569 159.4
[M+NH4]+ 257.07029 155.9
[M+K]+ 277.99963 155.5
[M-H]- 238.02919 152.8
[M+Na-2H]- 260.01114 155.5
[M]+ 239.03592 151.9
[M]- 239.03702 151.9
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe