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2H-1,4-Thiazine-2-acetamide, N-(3-chlorophenyl)tetrahydro-3-oxo-

View entire compound with spectra: 1 NMR, 1 FTIR, and 1 MS (GC)

2H-1,4-Thiazine-2-acetamide, N-(3-chlorophenyl)tetrahydro-3-oxo-
SpectraBase Compound ID GY8FhJQ3lQi
InChI InChI=1S/C12H13ClN2O2S/c13-8-2-1-3-9(6-8)15-11(16)7-10-12(17)14-4-5-18-10/h1-3,6,10H,4-5,7H2,(H,14,17)(H,15,16)
InChIKey NOVSTNSQVOXPFL-UHFFFAOYSA-N
Mol Weight 284.76 g/mol
Molecular Formula C12H13ClN2O2S
Exact Mass 284.038627 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID FerSLBxRd7u
Name 2H-1,4-Thiazine-2-acetamide, N-(3-chlorophenyl)tetrahydro-3-oxo-
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 284.038626539 u
Formula C12H13ClN2O2S
InChI InChI=1S/C12H13ClN2O2S/c13-8-2-1-3-9(6-8)15-11(16)7-10-12(17)14-4-5-18-10/h1-3,6,10H,4-5,7H2,(H,14,17)(H,15,16)
InChIKey NOVSTNSQVOXPFL-UHFFFAOYSA-N
SMILES C1(C(CC(NC2=CC=CC(=C2)Cl)=O)SCCN1)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.951521