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3.alpha.-Ethyl-3,4-dihydro-2.beta.-(4'-methoxy-2'-oxo-2'H-1'-benzopyran-3'-yl)-2H,5H-pyrano[3,2-c][1]benzopyran-5-one
SpectraBase Compound ID 1e7NHjcXPsH
InChI InChI=1S/C24H20O6/c1-3-13-12-16-21(14-8-4-6-10-17(14)28-23(16)25)30-20(13)19-22(27-2)15-9-5-7-11-18(15)29-24(19)26/h4-11,13,20H,3,12H2,1-2H3/t13-,20-/m0/s1
InChIKey PBANAROUGAMCEJ-RBZFPXEDSA-N
Mol Weight 404.42 g/mol
Molecular Formula C24H20O6
Exact Mass 404.125988 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3LcHhX2wFGR
Name 3.alpha.-Ethyl-3,4-dihydro-2.beta.-(4'-methoxy-2'-oxo-2'H-1'-benzopyran-3'-yl)-2H,5H-pyrano[3,2-c][1]benzopyran-5-one
CAS Registry Number 132356-53-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H20O6
InChI InChI=1S/C24H20O6/c1-3-13-12-16-21(14-8-4-6-10-17(14)28-23(16)25)30-20(13)19-22(27-2)15-9-5-7-11-18(15)29-24(19)26/h4-11,13,20H,3,12H2,1-2H3/t13-,20-/m0/s1
InChIKey PBANAROUGAMCEJ-RBZFPXEDSA-N
Molecular Weight 404.418 g/mol
SMILES C1(=C(c2ccccc2OC1=O)OC)[C@]1(OC=2c3c(cccc3)OC(C2C[C@@]1(CC)[H])=O)[H]
SPLASH splash10-0gc0-0490300000-b0f81310b353da7ee688
Source of Spectrum H-73-1873-0
Synonyms (2S,3S)-3-ethyl-2-(4-methoxy-2-oxo-2H-chromen-3-yl)-3,4-dihydro-2H,5H-pyrano[3,2-c]chromen-5-one
Wiley ID 1371393