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2-Acetamidophenoxathin

View entire compound with spectra: 1 FTIR

2-Acetamidophenoxathin
SpectraBase Compound ID 6BUfa8Ekgqp
InChI InChI=1S/C14H11NO2S/c1-9(16)15-10-6-7-12-14(8-10)18-13-5-3-2-4-11(13)17-12/h2-8H,1H3,(H,15,16)
InChIKey PELJTUWPZOAGNW-UHFFFAOYSA-N
Mol Weight 257.31 g/mol
Molecular Formula C14H11NO2S
Exact Mass 257.05105 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 45yoOks7nQA
Name 2-Acetamidophenoxathin
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 257.051049770 u
Formula C14H11NO2S
InChI InChI=1S/C14H11NO2S/c1-9(16)15-10-6-7-12-14(8-10)18-13-5-3-2-4-11(13)17-12/h2-8H,1H3,(H,15,16)
InChIKey PELJTUWPZOAGNW-UHFFFAOYSA-N
Molecular Weight 257.307 g/mol
SMILES CC(=O)NC1=CC2=C(OC=3C=CC=CC3S2)C=C1
Spectrum/Structure Validation Score (Vapor Phase IR) 0.954513