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2H,6H-Benzo[1,2-b:5,4-b']dipyran-6-one, 3,4-dihydro-7-hydroxy-2,2-dimethyl-8-(4-methylphenyl)-
SpectraBase Compound ID 9dbNi98vG5y
InChI InChI=1S/C21H20O4/c1-12-4-6-13(7-5-12)20-19(23)18(22)15-10-14-8-9-21(2,3)25-16(14)11-17(15)24-20/h4-7,10-11,23H,8-9H2,1-3H3
InChIKey VIWXVKIVCJJBPG-UHFFFAOYSA-N
Mol Weight 336.39 g/mol
Molecular Formula C21H20O4
Exact Mass 336.136159 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID L0MBc2nCuDP
Name 2H,6H-Benzo[1,2-b:5,4-b']dipyran-6-one, 3,4-dihydro-7-hydroxy-2,2-dimethyl-8-(4-methylphenyl)-
CAS Registry Number 104946-06-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H20O4
InChI InChI=1S/C21H20O4/c1-12-4-6-13(7-5-12)20-19(23)18(22)15-10-14-8-9-21(2,3)25-16(14)11-17(15)24-20/h4-7,10-11,23H,8-9H2,1-3H3
InChIKey VIWXVKIVCJJBPG-UHFFFAOYSA-N
Molecular Weight 336.387 g/mol
SMILES OC1=C(Oc2c(C1=O)cc1CCC(Oc1c2)(C)C)c1ccc(cc1)C
SPLASH splash10-000i-0239000000-9417e241584952024cf6
Source of Spectrum AJ-58-3665-6
Synonyms 3-Hydroxy-8,8-dimethyl-2-(4-methylphenyl)-7,8-dihydro-4H,6H-benzo[1,2-b:5,4-b']dipyran-4-one 7-Hydroxy-2,2-dimethyl-8-(4-methylphenyl)-3,4-dihydro-2H,6H-pyrano[3,2-g]chromen-6-one
Wiley ID 1332623