CID 2834468

3-oxo-n-phenyl-2h-1,4-benzothiazine-2-acetamide

Structural Information

Molecular Formula
C16H14N2O2S
SMILES
C1=CC=C(C=C1)NC(=O)CC2C(=O)NC3=CC=CC=C3S2
InChI
InChI=1S/C16H14N2O2S/c19-15(17-11-6-2-1-3-7-11)10-14-16(20)18-12-8-4-5-9-13(12)21-14/h1-9,14H,10H2,(H,17,19)(H,18,20)
InChIKey
RVRPQUZFIPCUAD-UHFFFAOYSA-N
Compound name
2-(3-oxo-4H-1,4-benzothiazin-2-yl)-N-phenylacetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

3
References

0
Patents

298.0776 Da
Monoisotopic Mass

2.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 299.08488 164.5
[M+Na]+ 321.06682 170.6
[M-H]- 297.07032 168.7
[M+NH4]+ 316.11142 178.4
[M+K]+ 337.04076 164.4
[M+H-H2O]+ 281.07486 156.5
[M+HCOO]- 343.07580 178.1
[M+CH3COO]- 357.09145 174.3
[M+Na-2H]- 319.05227 168.2
[M]+ 298.07705 162.1
[M]- 298.07815 162.1
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.