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(3R,4R)-3-Acetyl-4-hydroxy-7,8-dimethoxyisochroman-1-one
SpectraBase Compound ID 4hfHigyI4gR
InChI InChI=1S/C13H14O6/c1-6(14)11-10(15)7-4-5-8(17-2)12(18-3)9(7)13(16)19-11/h4-5,10-11,15H,1-3H3/t10-,11+/m1/s1
InChIKey XJOXMKZCXCVXSB-MNOVXSKESA-N
Mol Weight 266.25 g/mol
Molecular Formula C13H14O6
Exact Mass 266.079038 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5wEVyqNws60
Name (3R,4R)-3-Acetyl-4-hydroxy-7,8-dimethoxyisochroman-1-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H14O6
InChI InChI=1S/C13H14O6/c1-6(14)11-10(15)7-4-5-8(17-2)12(18-3)9(7)13(16)19-11/h4-5,10-11,15H,1-3H3/t10-,11+/m1/s1
InChIKey XJOXMKZCXCVXSB-MNOVXSKESA-N
Molecular Weight 266.249 g/mol
SMILES O[C@]1([C@](C(=O)C)(OC(c2c1ccc(c2OC)OC)=O)[H])[H]
SPLASH splash10-002e-0890000000-44566a50039c1c298183
Source of Spectrum F4-45-1712-8e
Wiley ID 1737051