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2,6-Bis[3,4-(methylenedioxy)phenyl]-bicyclo[3.3.0]octane-3.beta.,7.beta.-diol
SpectraBase Compound ID 6g1moGWJKtg
InChI InChI=1S/C22H22O6/c23-15-8-14-13(21(15)11-1-3-17-19(5-11)27-9-25-17)7-16(24)22(14)12-2-4-18-20(6-12)28-10-26-18/h1-6,13-16,21-24H,7-10H2/t13?,14?,15-,16-,21?,22?/m1/s1
InChIKey JEIZVSDARNXPRU-LFPRWPMZSA-N
Mol Weight 382.41 g/mol
Molecular Formula C22H22O6
Exact Mass 382.141638 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3VIjoFMtUsZ
Name 2,6-Bis[3,4-(methylenedioxy)phenyl]-bicyclo[3.3.0]octane-3.beta.,7.beta.-diol
Alternate Name(s) (2R,5R)-1,4-di(1,3-benzodioxol-5-yl)octahydro-2,5-pentalenediol 2,6-bis[3,4-(methylenedioxy)phenyl]-3,7-dioxobicyclo[3.3.0]octane-3.beta.,7.beta.-diol
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Formula C22H22O6
InChI InChI=1S/C22H22O6/c23-15-8-14-13(21(15)11-1-3-17-19(5-11)27-9-25-17)7-16(24)22(14)12-2-4-18-20(6-12)28-10-26-18/h1-6,13-16,21-24H,7-10H2/t13?,14?,15-,16-,21?,22?/m1/s1
InChIKey JEIZVSDARNXPRU-LFPRWPMZSA-N
Molecular Weight 382.412 g/mol
SMILES O[C@]1(C(C2C(C([C@@](C2)(O)[H])c2cc3OCOc3cc2)C1)c1cc2OCOc2cc1)[H]
SPLASH splash10-03dj-0009000000-aff8f3104deb814c0f89
Source of Spectrum J-60-3062-26
Wiley ID 1360619