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rel-(1R,2R,2aS,9bR)-1,2,2a,9b-Tetrahydro-9-methoxy-1-(7-methoxy-1,3-benzodioxol-5-yl)-2-methyl-3H-cyclobuta[c]furo[3,2-g][1]benzopyran-3-one

View entire compound with spectra: 1 MS (GC)

rel-(1R,2R,2aS,9bR)-1,2,2a,9b-Tetrahydro-9-methoxy-1-(7-methoxy-1,3-benzodioxol-5-yl)-2-methyl-3H-cyclobuta[c]furo[3,2-g][1]benzopyran-3-one
SpectraBase Compound ID LIzUAP4LkgZ
InChI InChI=1S/C23H20O7/c1-10-17(11-6-15(25-2)22-16(7-11)28-9-29-22)20-18(10)23(24)30-14-8-13-12(4-5-27-13)21(26-3)19(14)20/h4-8,10,17-18,20H,9H2,1-3H3/t10-,17+,18+,20-/m1/s1
InChIKey LFHZRNLDFDEWNG-XXGZNAFDSA-N
Mol Weight 408.41 g/mol
Molecular Formula C23H20O7
Exact Mass 408.120903 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2pyp084JcUE
Name rel-(1R,2R,2aS,9bR)-1,2,2a,9b-Tetrahydro-9-methoxy-1-(7-methoxy-1,3-benzodioxol-5-yl)-2-methyl-3H-cyclobuta[c]furo[3,2-g][1]benzopyran-3-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H20O7
InChI InChI=1S/C23H20O7/c1-10-17(11-6-15(25-2)22-16(7-11)28-9-29-22)20-18(10)23(24)30-14-8-13-12(4-5-27-13)21(26-3)19(14)20/h4-8,10,17-18,20H,9H2,1-3H3/t10-,17+,18+,20-/m1/s1
InChIKey LFHZRNLDFDEWNG-XXGZNAFDSA-N
Literature Reference DOI 10.1002/hlca.200690002
Molecular Weight 408.406 g/mol
SMILES c1(OC)cc(cc2OCOc12)[C@]1([C@]2(c3c(OC(=O)[C@]2([C@@]1(C)[H])[H])cc1c(c3OC)cco1)[H])[H]
SPLASH splash10-0006-0900000000-65a4dfbeec4b7931fd5a
Source of Spectrum H-89-120-1
Synonyms Lindleyanin (1R,2R,2aS,9bR)-9-methoxy-1-(7-methoxybenzo[d][1,3]dioxol-5-yl)-2-methyl-1,2,2a,9b-tetrahydro-3H-cyclobuta[c]furo[3,2-g]chromen-3-one
Wiley ID 1785636