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(9R,10R)-8,8-dimethyl-9-[(Z)-2-methylbut-2-enoyl]oxy-2-oxo-9,10-dihydropyrano[2,3-f]chromene-10-yl(Z)-2-methylbut-2-enoate

View entire compound with spectra: 1 MS (GC)

(9R,10R)-8,8-dimethyl-9-[(Z)-2-methylbut-2-enoyl]oxy-2-oxo-9,10-dihydropyrano[2,3-f]chromene-10-yl(Z)-2-methylbut-2-enoate
SpectraBase Compound ID DITHrZIRVb3
InChI InChI=1S/C24H26O7/c1-7-13(3)22(26)29-20-18-16(11-9-15-10-12-17(25)28-19(15)18)31-24(5,6)21(20)30-23(27)14(4)8-2/h7-12,20-21H,1-6H3/b13-7-,14-8-/t20-,21-/m1/s1
InChIKey PNTWXEIQXBRCPS-IOWUNYDSSA-N
Mol Weight 426.47 g/mol
Molecular Formula C24H26O7
Exact Mass 426.167853 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8jBI4fXaRVt
Name (9R,10R)-8,8-dimethyl-9-[(Z)-2-methylbut-2-enoyl]oxy-2-oxo-9,10-dihydropyrano[2,3-f]chromene-10-yl(Z)-2-methylbut-2-enoate
Appearance crystalline
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H26O7
InChI InChI=1S/C24H26O7/c1-7-13(3)22(26)29-20-18-16(11-9-15-10-12-17(25)28-19(15)18)31-24(5,6)21(20)30-23(27)14(4)8-2/h7-12,20-21H,1-6H3/b13-7-,14-8-/t20-,21-/m1/s1
InChIKey PNTWXEIQXBRCPS-IOWUNYDSSA-N
Ionization Type EI
Literature Reference DOI 10.1002/cbdv.202200167
Molecular Weight 426.465 g/mol
SMILES [C@@]1([C@@](c2c(OC1(C)C)ccc1c2OC(C=C1)=O)(OC(\C(=C/C)C)=O)[H])(OC(\C(=C/C)C)=O)[H]
SPLASH splash10-004i-7196000000-8ff8c011c88c78714aff
Source of Spectrum CBD-19-SM3-Anomalin
Synonyms Anomalin Praeruptorin B 2',2'-dimethyl-3',4'-diangeloyl-3',4'-dihydropyrano-5',6':8,7-coumarin
Wiley ID 1876076