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Phenol, 2-[3-oxododecanoyl]-

View entire compound with spectra: 1 NMR, and 1 FTIR

Phenol, 2-[3-oxododecanoyl]-
SpectraBase Compound ID 8xrq5bFlk56
InChI InChI=1S/C18H26O3/c1-2-3-4-5-6-7-8-11-15(19)14-18(21)16-12-9-10-13-17(16)20/h9-10,12-13,20H,2-8,11,14H2,1H3
InChIKey BOCZHDNKOXONMK-UHFFFAOYSA-N
Mol Weight 290.4 g/mol
Molecular Formula C18H26O3
Exact Mass 290.188195 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 1vNCuCJAJAm
Name Phenol, 2-[3-oxododecanoyl]-
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 290.188194694 u
Formula C18H26O3
InChI InChI=1S/C18H26O3/c1-2-3-4-5-6-7-8-11-15(19)14-18(21)16-12-9-10-13-17(16)20/h9-10,12-13,20H,2-8,11,14H2,1H3
InChIKey BOCZHDNKOXONMK-UHFFFAOYSA-N
Molecular Weight 290.403 g/mol
SMILES C1(=C(C=CC=C1)C(CC(CCCCCCCCC)=O)=O)O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.81584