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(1S,3S,4R )-4,7-Diacetoxy-8-methoxy-1,3-dimethylisochroman
SpectraBase Compound ID DGTY6aJUNxl
InChI InChI=1S/C16H20O6/c1-8-14-12(15(9(2)20-8)22-11(4)18)6-7-13(16(14)19-5)21-10(3)17/h6-9,15H,1-5H3/t8-,9-,15-/m0/s1
InChIKey GFHCIEBMSFRZSJ-UTEYVOQOSA-N
Mol Weight 308.33 g/mol
Molecular Formula C16H20O6
Exact Mass 308.125988 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GJAw72luvG7
Name (1S,3S,4R )-4,7-Diacetoxy-8-methoxy-1,3-dimethylisochroman
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H20O6
InChI InChI=1S/C16H20O6/c1-8-14-12(15(9(2)20-8)22-11(4)18)6-7-13(16(14)19-5)21-10(3)17/h6-9,15H,1-5H3/t8-,9-,15-/m0/s1
InChIKey GFHCIEBMSFRZSJ-UTEYVOQOSA-N
Molecular Weight 308.330 g/mol
SMILES c12c([C@@](OC(=O)C)([C@@](O[C@]2(C)[H])(C)[H])[H])ccc(c1OC)OC(=O)C
SPLASH splash10-053u-0960000000-a665b45a5f96b362f581
Source of Spectrum B-53-346-22
Synonyms (1S,3S,4R)-4-(acetyloxy)-8-methoxy-1,3-dimethyl-3,4-dihydro-1H-2-benzopyran-7-yl acetate
Wiley ID 747031