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4-Formyl-2-(4-bromophenyl)-1,4-benzothiazine

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4-Formyl-2-(4-bromophenyl)-1,4-benzothiazine
SpectraBase Compound ID 9uVsHCe2FAq
InChI InChI=1S/C15H10BrNOS/c16-12-7-5-11(6-8-12)15-9-17(10-18)13-3-1-2-4-14(13)19-15/h1-10H
InChIKey LFDMCANLEMGTGP-UHFFFAOYSA-N
Mol Weight 332.22 g/mol
Molecular Formula C15H10BrNOS
Exact Mass 330.966648 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 9AZaf97LjQp
Name 4-Formyl-2-(4-bromophenyl)-1,4-benzothiazine
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 330.966648119 u
Formula C15H10BrNOS
InChI InChI=1S/C15H10BrNOS/c16-12-7-5-11(6-8-12)15-9-17(10-18)13-3-1-2-4-14(13)19-15/h1-10H
InChIKey LFDMCANLEMGTGP-UHFFFAOYSA-N
Molecular Weight 332.215 g/mol
SMILES C=1(SC=2C(N(C1)C=O)=CC=CC2)C=1C=CC(=CC1)Br
Spectrum/Structure Validation Score (Vapor Phase IR) 0.905312