CID 3061048

78593-83-6

Structural Information

Molecular Formula
C15H16N2O2S
SMILES
C1CC2CC1C3=CN(C=C23)C4=CC=C(C=C4)S(=O)(=O)N
InChI
InChI=1S/C15H16N2O2S/c16-20(18,19)13-5-3-12(4-6-13)17-8-14-10-1-2-11(7-10)15(14)9-17/h3-6,8-11H,1-2,7H2,(H2,16,18,19)
InChIKey
AWNVTHSGNWDGCZ-UHFFFAOYSA-N
Compound name
4-(4-azatricyclo[5.2.1.02,6]deca-2,5-dien-4-yl)benzenesulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

288.09326 Da
Monoisotopic Mass

2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 289.10054 167.1
[M+Na]+ 311.08248 177.3
[M-H]- 287.08598 174.0
[M+NH4]+ 306.12708 190.0
[M+K]+ 327.05642 173.4
[M+H-H2O]+ 271.09052 163.6
[M+HCOO]- 333.09146 183.8
[M+CH3COO]- 347.10711 179.8
[M+Na-2H]- 309.06793 167.9
[M]+ 288.09271 170.3
[M]- 288.09381 170.3
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

No patent data available for this compound.