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9H-Xanthene-9-carboxylic acid phenethyl-amide

View entire compound with spectra: 2 NMR, 1 FTIR, and 1 MS (GC)

9H-Xanthene-9-carboxylic acid phenethyl-amide
SpectraBase Compound ID CtgWNuBnZ7M
InChI InChI=1S/C22H19NO2/c24-22(23-15-14-16-8-2-1-3-9-16)21-17-10-4-6-12-19(17)25-20-13-7-5-11-18(20)21/h1-13,21H,14-15H2,(H,23,24)
InChIKey GXJBSTGPKOHKEC-UHFFFAOYSA-N
Mol Weight 329.4 g/mol
Molecular Formula C22H19NO2
Exact Mass 329.141579 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID G3DZMzvOUq9
Name 9H-Xanthene-9-carboxylic acid phenethyl-amide
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 329.141578854 u
Formula C22H19NO2
InChI InChI=1S/C22H19NO2/c24-22(23-15-14-16-8-2-1-3-9-16)21-17-10-4-6-12-19(17)25-20-13-7-5-11-18(20)21/h1-13,21H,14-15H2,(H,23,24)
InChIKey GXJBSTGPKOHKEC-UHFFFAOYSA-N
Molecular Weight 329.399 g/mol
SMILES C1(C2=C(OC3=C1C=CC=C3)C=CC=C2)C(NCCC1=CC=CC=C1)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.9606