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(7S,8R)-5-methoxy-2-methyl-3-phenyl-bicyclo[4.2.0]octa-1(6),2,4-triene-4,7,8-triol
SpectraBase Compound ID 6M6MVRyaFpw
InChI InChI=1S/C16H16O4/c1-8-10(9-6-4-3-5-7-9)15(19)16(20-2)12-11(8)13(17)14(12)18/h3-7,13-14,17-19H,1-2H3/t13-,14+/m1/s1
InChIKey CNFBFEAVCULPMX-KGLIPLIRSA-N
Mol Weight 272.3 g/mol
Molecular Formula C16H16O4
Exact Mass 272.104859 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID wmsjyYuYMa
Name (7S,8R)-5-methoxy-2-methyl-3-phenyl-bicyclo[4.2.0]octa-1(6),2,4-triene-4,7,8-triol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H16O4
InChI InChI=1S/C16H16O4/c1-8-10(9-6-4-3-5-7-9)15(19)16(20-2)12-11(8)13(17)14(12)18/h3-7,13-14,17-19H,1-2H3/t13-,14+/m1/s1
InChIKey CNFBFEAVCULPMX-KGLIPLIRSA-N
Molecular Weight 272.300 g/mol
SMILES Oc1c(c(c2c([C@@]([C@@]2(O)[H])(O)[H])c1OC)C)-c1ccccc1
SPLASH splash10-05fr-0090000000-63f025e41c79583e05d6
Source of Spectrum F-68-543-5
Wiley ID 1571609