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2,3,6-trimethoxy-1,4-naphthoquinone
SpectraBase Compound ID 6SbIAaTur1O
InChI InChI=1S/C13H12O5/c1-16-7-4-5-8-9(6-7)11(15)13(18-3)12(17-2)10(8)14/h4-6H,1-3H3
InChIKey YFUPODDBGOIXKI-UHFFFAOYSA-N
Mol Weight 248.23 g/mol
Molecular Formula C13H12O5
Exact Mass 248.068473 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 57NnB0iYFwh
Name 2,3,6-trimethoxy-1,4-naphthoquinone
CAS Registry Number 62345-17-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H12O5
InChI InChI=1S/C13H12O5/c1-16-7-4-5-8-9(6-7)11(15)13(18-3)12(17-2)10(8)14/h4-6H,1-3H3
InChIKey YFUPODDBGOIXKI-UHFFFAOYSA-N
Molecular Weight 248.234 g/mol
SMILES C1(=C(C(=O)c2c(C1=O)cc(cc2)OC)OC)OC
SPLASH splash10-001i-2790000000-59f6eaa8cf280f34816c
Source of Spectrum J-53-1001-2
Synonyms 2,3,6-trimethoxynaphthalene-1,4-dione
Wiley ID 1250873