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1,4-Naphthalenedione, 8-methoxy-2-(6-methyl-1,5-dioxoheptyl)-
SpectraBase Compound ID BSqjtyHi7H
InChI InChI=1S/C19H20O5/c1-11(2)14(20)7-5-8-15(21)13-10-16(22)12-6-4-9-17(24-3)18(12)19(13)23/h4,6,9-11H,5,7-8H2,1-3H3
InChIKey FIJMDWYSPLUAKA-UHFFFAOYSA-N
Mol Weight 328.36 g/mol
Molecular Formula C19H20O5
Exact Mass 328.131074 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1RwcQf3HMw1
Name 1,4-Naphthalenedione, 8-methoxy-2-(6-methyl-1,5-dioxoheptyl)-
CAS Registry Number 95455-95-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H20O5
InChI InChI=1S/C19H20O5/c1-11(2)14(20)7-5-8-15(21)13-10-16(22)12-6-4-9-17(24-3)18(12)19(13)23/h4,6,9-11H,5,7-8H2,1-3H3
InChIKey FIJMDWYSPLUAKA-UHFFFAOYSA-N
Molecular Weight 328.364 g/mol
SMILES C=1(C(c2c(OC)cccc2C(C1)=O)=O)C(=O)CCCC(=O)C(C)C
SPLASH splash10-069c-0092000000-3056b3520687dd227c09
Source of Spectrum F-40-4734-0
Synonyms 5-Methoxy-3-(6-methyl-5-oxoheptanoyl)-1,4-naphthoquinone 8-Methoxy-2-(6-methyl-5-oxoheptanoyl)naphthoquinone
Wiley ID 1326344