CID 15895424

195447-72-4

Structural Information

Molecular Formula
C11H11BrN2O3S
SMILES
CC1=C(ON=C1NS(=O)(=O)C2=CC=CC=C2Br)C
InChI
InChI=1S/C11H11BrN2O3S/c1-7-8(2)17-13-11(7)14-18(15,16)10-6-4-3-5-9(10)12/h3-6H,1-2H3,(H,13,14)
InChIKey
AEHZMTLXZJYRCA-UHFFFAOYSA-N
Compound name
2-bromo-N-(4,5-dimethyl-1,2-oxazol-3-yl)benzenesulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

40
Patents

329.96738 Da
Monoisotopic Mass

2.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 330.97466 157.2
[M+Na]+ 352.95660 159.9
[M+NH4]+ 348.00120 160.7
[M+K]+ 368.93054 161.4
[M-H]- 328.96010 159.0
[M+Na-2H]- 350.94205 160.3
[M]+ 329.96683 157.3
[M]- 329.96793 157.3
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