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2-(4-Benzoylphenoxy)ethyl tetrahydro-2H-pyran-2-yl ester
SpectraBase Compound ID SxM2M3FeCV
InChI InChI=1S/C20H22O4/c21-20(16-6-2-1-3-7-16)17-9-11-18(12-10-17)22-14-15-24-19-8-4-5-13-23-19/h1-3,6-7,9-12,19H,4-5,8,13-15H2
InChIKey YGAWWNBMCJQEKT-UHFFFAOYSA-N
Mol Weight 326.39 g/mol
Molecular Formula C20H22O4
Exact Mass 326.151809 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 1RfbbiJj4tL
Name 2-(4-Benzoylphenoxy)ethyl tetrahydro-2H-pyran-2-yl ester
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 326.151809184 u
Formula C20H22O4
InChI InChI=1S/C20H22O4/c21-20(16-6-2-1-3-7-16)17-9-11-18(12-10-17)22-14-15-24-19-8-4-5-13-23-19/h1-3,6-7,9-12,19H,4-5,8,13-15H2
InChIKey YGAWWNBMCJQEKT-UHFFFAOYSA-N
Molecular Weight 326.392 g/mol
SMILES C(C1=CC=C(C=C1)OCCOC1OCCCC1)(=O)C1=CC=CC=C1
Spectrum/Structure Validation Score (Vapor Phase IR) 0.959864