CID 3055902

2-benzoxazolemethanesulfonamide

Structural Information

Molecular Formula
C8H8N2O3S
SMILES
C1=CC=C2C(=C1)N=C(O2)CS(=O)(=O)N
InChI
InChI=1S/C8H8N2O3S/c9-14(11,12)5-8-10-6-3-1-2-4-7(6)13-8/h1-4H,5H2,(H2,9,11,12)
InChIKey
OCBFIYONEZGJAF-UHFFFAOYSA-N
Compound name
1,3-benzoxazol-2-ylmethanesulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

3
Patents

212.02556 Da
Monoisotopic Mass

0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 213.03284 140.4
[M+Na]+ 235.01478 152.0
[M-H]- 211.01828 145.2
[M+NH4]+ 230.05938 159.8
[M+K]+ 250.98872 149.9
[M+H-H2O]+ 195.02282 135.1
[M+HCOO]- 257.02376 160.2
[M+CH3COO]- 271.03941 182.2
[M+Na-2H]- 233.00023 148.1
[M]+ 212.02501 145.5
[M]- 212.02611 145.5
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