CID 2834468

101350-88-3

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]+ 299.084876 164.5
[M+Na]+ 321.066818 170.6
[M-H]- 297.070324 168.7
[M+NH4]+ 316.111423 178.4
[M+K]+ 337.040758 164.4
[M+H-H2O]+ 281.074860 156.5
[M+HCOO]- 343.075801 178.1
[M+CH3COO]- 357.091451 174.3
[M+Na-2H]- 319.052266 168.2
[M]+ 298.07705142 162.1
[M]- 298.07814858 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.