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9,10-Anthracenedione, 1-(hexyloxy)-2-methyl-
SpectraBase Compound ID C2aNJ0tCNyB
InChI InChI=1S/C21H22O3/c1-3-4-5-8-13-24-21-14(2)11-12-17-18(21)20(23)16-10-7-6-9-15(16)19(17)22/h6-7,9-12H,3-5,8,13H2,1-2H3
InChIKey LJHLRAWEINAYMM-UHFFFAOYSA-N
Mol Weight 322.4 g/mol
Molecular Formula C21H22O3
Exact Mass 322.156895 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KzRgocLgsQX
Name 9,10-Anthracenedione, 1-(hexyloxy)-2-methyl-
Alternate Name(s) 1-(hexyloxy)-2-methyl-9,10-anthraquinone 1-(hexyloxy)-2-methylanthra-9,10-quinone
CAS Registry Number 133473-27-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H22O3
InChI InChI=1S/C21H22O3/c1-3-4-5-8-13-24-21-14(2)11-12-17-18(21)20(23)16-10-7-6-9-15(16)19(17)22/h6-7,9-12H,3-5,8,13H2,1-2H3
InChIKey LJHLRAWEINAYMM-UHFFFAOYSA-N
Molecular Weight 322.404 g/mol
SMILES c12C(c3ccccc3C(c2ccc(c1OCCCCCC)C)=O)=O
SPLASH splash10-0f79-0090000000-d3d8221520766fe460ea
Source of Spectrum C-113-3512-8
Wiley ID 1322077