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10-(2,6-Dihydroxyphenyl)-10-oxodecanal

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

10-(2,6-Dihydroxyphenyl)-10-oxodecanal
SpectraBase Compound ID IenoetN43t4
InChI InChI=1S/C16H22O4/c17-12-7-5-3-1-2-4-6-9-13(18)16-14(19)10-8-11-15(16)20/h8,10-12,19-20H,1-7,9H2
InChIKey BBINNVYOUSCKMJ-UHFFFAOYSA-N
Mol Weight 278.35 g/mol
Molecular Formula C16H22O4
Exact Mass 278.151809 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID HytnbyTly0g
Name 10-(2,6-Dihydroxyphenyl)-10-oxodecanal
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 278.151809184 u
Formula C16H22O4
InChI InChI=1S/C16H22O4/c17-12-7-5-3-1-2-4-6-9-13(18)16-14(19)10-8-11-15(16)20/h8,10-12,19-20H,1-7,9H2
InChIKey BBINNVYOUSCKMJ-UHFFFAOYSA-N
Molecular Weight 278.348 g/mol
SMILES C1=CC=C(C(=C1O)C(CCCCCCCCC=O)=O)O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.953614