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2-(2,2-Dimethyl-6-oxo-6H-[1,3]dioxine-4-ylmethyl)-3-methyl-[1,4]naphthoquinone
SpectraBase Compound ID GHwVfHWkOhh
InChI InChI=1S/C18H16O5/c1-10-14(8-11-9-15(19)23-18(2,3)22-11)17(21)13-7-5-4-6-12(13)16(10)20/h4-7,9H,8H2,1-3H3
InChIKey MQWZHMLXFWKBLF-UHFFFAOYSA-N
Mol Weight 312.32 g/mol
Molecular Formula C18H16O5
Exact Mass 312.099774 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3EXOvlLlke3
Name 2-(2,2-Dimethyl-6-oxo-6H-[1,3]dioxine-4-ylmethyl)-3-methyl-[1,4]naphthoquinone
Alternate Name(s) 2-((2,2-dimethyl-4-oxo-4H-1,3-dioxin-6-yl)methyl)-3-methylnaphthalene-1,4-dione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H16O5
InChI InChI=1S/C18H16O5/c1-10-14(8-11-9-15(19)23-18(2,3)22-11)17(21)13-7-5-4-6-12(13)16(10)20/h4-7,9H,8H2,1-3H3
InChIKey MQWZHMLXFWKBLF-UHFFFAOYSA-N
Literature Reference DOI 10.1002/prac.19973390123
Molecular Weight 312.321 g/mol
SMILES C1(C(=C(C(c2ccccc12)=O)C)CC=1OC(OC(C1)=O)(C)C)=O
SPLASH splash10-000i-4950000000-132534ea44b56bda3525
Source of Spectrum JF-339-118-18
Wiley ID 1766527