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2,2,5-trimethoxy-3,4-dihydronaphthalen-1-one
SpectraBase Compound ID 98Wzre9LYIZ
InChI InChI=1S/C13H16O4/c1-15-11-6-4-5-10-9(11)7-8-13(16-2,17-3)12(10)14/h4-6H,7-8H2,1-3H3
InChIKey ZIZQILBFUPJSCJ-UHFFFAOYSA-N
Mol Weight 236.27 g/mol
Molecular Formula C13H16O4
Exact Mass 236.104859 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5RJEORIiXka
Name 2,2,5-trimethoxy-3,4-dihydronaphthalen-1-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H16O4
InChI InChI=1S/C13H16O4/c1-15-11-6-4-5-10-9(11)7-8-13(16-2,17-3)12(10)14/h4-6H,7-8H2,1-3H3
InChIKey ZIZQILBFUPJSCJ-UHFFFAOYSA-N
Molecular Weight 236.267 g/mol
SMILES C1(c2c(c(OC)ccc2)CCC1(OC)OC)=O
SPLASH splash10-004i-5920000000-4ad446ff22cfed3e3587
Source of Spectrum AT-44-8756-5
Synonyms 2,2,5-trimethoxytetralin-1-one
Wiley ID 1621822