CID 82355339

4-methyl-3,4-dihydro-2h-1,4-benzoxazine-6-sulfonamide

Structural Information

Molecular Formula
C9H12N2O3S
SMILES
CN1CCOC2=C1C=C(C=C2)S(=O)(=O)N
InChI
InChI=1S/C9H12N2O3S/c1-11-4-5-14-9-3-2-7(6-8(9)11)15(10,12)13/h2-3,6H,4-5H2,1H3,(H2,10,12,13)
InChIKey
HFAUGJRUKQKZMS-UHFFFAOYSA-N
Compound name
4-methyl-2,3-dihydro-1,4-benzoxazine-6-sulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

228.05687 Da
Monoisotopic Mass

0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 229.06415 146.5
[M+Na]+ 251.04609 157.6
[M+NH4]+ 246.09069 154.1
[M+K]+ 267.02003 151.5
[M-H]- 227.04959 148.9
[M+Na-2H]- 249.03154 150.5
[M]+ 228.05632 149.1
[M]- 228.05742 149.1
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.