CID 208260

2-benzyl-2h-1,2-benzothiazin-3(4h)-one 1,1-dioxide

Structural Information

Molecular Formula
C15H13NO3S
SMILES
C1C2=CC=CC=C2S(=O)(=O)N(C1=O)CC3=CC=CC=C3
InChI
InChI=1S/C15H13NO3S/c17-15-10-13-8-4-5-9-14(13)20(18,19)16(15)11-12-6-2-1-3-7-12/h1-9H,10-11H2
InChIKey
OZDQCCZKFFTJBX-UHFFFAOYSA-N
Compound name
2-benzyl-1,1-dioxo-4H-1lambda6,2-benzothiazin-3-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

287.0616 Da
Monoisotopic Mass

2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 288.06888 161.5
[M+Na]+ 310.05082 176.5
[M+NH4]+ 305.09542 171.5
[M+K]+ 326.02476 164.8
[M-H]- 286.05432 165.6
[M+Na-2H]- 308.03627 170.9
[M]+ 287.06105 165.5
[M]- 287.06215 165.5
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

No patent data available for this compound.