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5-Hydroxy-1-methoxy-2-(2'-methylprop-2'-enyl)-anthraquinone

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

5-Hydroxy-1-methoxy-2-(2'-methylprop-2'-enyl)-anthraquinone
SpectraBase Compound ID CgOyqCVNyHs
InChI InChI=1S/C19H16O4/c1-10(2)9-11-7-8-13-16(19(11)23-3)18(22)12-5-4-6-14(20)15(12)17(13)21/h4-8,20H,1,9H2,2-3H3
InChIKey JMKSLYRRFLTPHV-UHFFFAOYSA-N
Mol Weight 308.33 g/mol
Molecular Formula C19H16O4
Exact Mass 308.104859 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID D4kDHNPk7el
Name 5-Hydroxy-1-methoxy-2-(2'-methylprop-2'-enyl)-anthraquinone
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 308.104858991 u
Formula C19H16O4
InChI InChI=1S/C19H16O4/c1-10(2)9-11-7-8-13-16(19(11)23-3)18(22)12-5-4-6-14(20)15(12)17(13)21/h4-8,20H,1,9H2,2-3H3
InChIKey JMKSLYRRFLTPHV-UHFFFAOYSA-N
SMILES C1(=O)C2=C(C(C3=C(O)C=CC=C13)=O)C=CC(=C2OC)CC(=C)C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.867041