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1,4-Naphthalenedione, 2-(6,6-dimethyl-1,5-dioxoheptyl)-8-methoxy-
SpectraBase Compound ID 6KkbZf4fVeG
InChI InChI=1S/C20H22O5/c1-20(2,3)17(23)10-6-8-14(21)13-11-15(22)12-7-5-9-16(25-4)18(12)19(13)24/h5,7,9,11H,6,8,10H2,1-4H3
InChIKey DNLGYINLZZHIFS-UHFFFAOYSA-N
Mol Weight 342.39 g/mol
Molecular Formula C20H22O5
Exact Mass 342.146724 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 72cplQ3OoyE
Name 1,4-Naphthalenedione, 2-(6,6-dimethyl-1,5-dioxoheptyl)-8-methoxy-
Alternate Name(s) 2-(6,6-dimethyl-5-oxoheptanoyl)-8-methoxynaphthoquinone 5-Methoxy-3-(6,6-dimethyl-5-oxoheptanoyl)-1,4-naphthoquinone
CAS Registry Number 95455-96-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H22O5
InChI InChI=1S/C20H22O5/c1-20(2,3)17(23)10-6-8-14(21)13-11-15(22)12-7-5-9-16(25-4)18(12)19(13)24/h5,7,9,11H,6,8,10H2,1-4H3
InChIKey DNLGYINLZZHIFS-UHFFFAOYSA-N
Molecular Weight 342.391 g/mol
SMILES C=1(C(c2c(OC)cccc2C(C1)=O)=O)C(=O)CCCC(C(C)(C)C)=O
SPLASH splash10-000i-0090000000-485bede42549d7826d62
Source of Spectrum F-40-4734-0
Wiley ID 1336645