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1,4-bis[(3',4'-Methylenedioxy)phenyl]-2,3-bis(dimethoxymethyl)butane
SpectraBase Compound ID 13HFISQAg2s
InChI InChI=1S/C22H26O6/c1-23-11-17(7-15-3-5-19-21(9-15)27-13-25-19)18(12-24-2)8-16-4-6-20-22(10-16)28-14-26-20/h3-6,9-10,17-18H,7-8,11-14H2,1-2H3/t17-,18-/m1/s1
InChIKey NQFDLHKMNTXMAG-QZTJIDSGSA-N
Mol Weight 386.44 g/mol
Molecular Formula C22H26O6
Exact Mass 386.172939 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID J5ZlK0QIw8x
Name 1,4-bis[(3',4'-Methylenedioxy)phenyl]-2,3-bis(dimethoxymethyl)butane
Alternate Name(s) Cubebin-dimethyl ether 5-[(2S,3S)-3-(1,3-benzodioxol-5-ylmethyl)-4-methoxy-2-(methoxymethyl)butyl]-1,3-benzodioxole
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H26O6
InChI InChI=1S/C22H26O6/c1-23-11-17(7-15-3-5-19-21(9-15)27-13-25-19)18(12-24-2)8-16-4-6-20-22(10-16)28-14-26-20/h3-6,9-10,17-18H,7-8,11-14H2,1-2H3/t17-,18-/m1/s1
InChIKey NQFDLHKMNTXMAG-QZTJIDSGSA-N
Molecular Weight 386.444 g/mol
SMILES c12c(OCO2)ccc(c1)C[C@@]([C@](Cc1cc2OCOc2cc1)(COC)[H])(COC)[H]
SPLASH splash10-000i-6900000000-40b2befee786d01c1565
Source of Spectrum G4-69-58-1
Wiley ID 1694643