CID 13455428

2,3-dihydro-1,4-benzodioxine-5-sulfonamide

Structural Information

Molecular Formula
C8H9NO4S
SMILES
C1COC2=C(O1)C=CC=C2S(=O)(=O)N
InChI
InChI=1S/C8H9NO4S/c9-14(10,11)7-3-1-2-6-8(7)13-5-4-12-6/h1-3H,4-5H2,(H2,9,10,11)
InChIKey
ATSDFKWVCBPSRH-UHFFFAOYSA-N
Compound name
2,3-dihydro-1,4-benzodioxine-5-sulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

10
Patents

215.02522 Da
Monoisotopic Mass

0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 216.03250 141.2
[M+Na]+ 238.01444 152.2
[M+NH4]+ 233.05904 149.1
[M+K]+ 253.98838 146.7
[M-H]- 214.01794 145.1
[M+Na-2H]- 235.99989 145.2
[M]+ 215.02467 144.3
[M]- 215.02577 144.3
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