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2-Acetyl-1,8-dihydroxy-3,6-dimethylnaphthalene

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

2-Acetyl-1,8-dihydroxy-3,6-dimethylnaphthalene
SpectraBase Compound ID 9RbdFxn2uaf
InChI InChI=1S/C14H14O3/c1-7-4-10-6-8(2)12(9(3)15)14(17)13(10)11(16)5-7/h4-6,16-17H,1-3H3
InChIKey TZAKEZMPPUTARG-UHFFFAOYSA-N
Mol Weight 230.26 g/mol
Molecular Formula C14H14O3
Exact Mass 230.094294 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 1tANTUen8yM
Name 2-Acetyl-1,8-dihydroxy-3,6-dimethylnaphthalene
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 230.094294308 u
Formula C14H14O3
InChI InChI=1S/C14H14O3/c1-7-4-10-6-8(2)12(9(3)15)14(17)13(10)11(16)5-7/h4-6,16-17H,1-3H3
InChIKey TZAKEZMPPUTARG-UHFFFAOYSA-N
Molecular Weight 230.263 g/mol
SMILES C1(O)=C(C(=O)C)C(C)=CC=2C=C(C)C=C(O)C12
Spectrum/Structure Validation Score (Vapor Phase IR) 0.926918