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Naphtho[2,3-d]-1,3-dioxole, 5,6,7,8-tetrahydro-6,7-dimethyl-5-[4-(phenylmethoxy)phenyl]-, (5.alpha.,6.beta.,7.alpha.)-(.+-.)-

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Naphtho[2,3-d]-1,3-dioxole, 5,6,7,8-tetrahydro-6,7-dimethyl-5-[4-(phenylmethoxy)phenyl]-, (5.alpha.,6.beta.,7.alpha.)-(.+-.)-
SpectraBase Compound ID 4bO0Wc11hEv
InChI InChI=1S/C26H26O3/c1-17-12-21-13-24-25(29-16-28-24)14-23(21)26(18(17)2)20-8-10-22(11-9-20)27-15-19-6-4-3-5-7-19/h3-11,13-14,17-18,26H,12,15-16H2,1-2H3/t17-,18+,26+/m0/s1
InChIKey XDJCEFWRUCMHOW-CUAXAMRHSA-N
Mol Weight 386.49 g/mol
Molecular Formula C26H26O3
Exact Mass 386.188195 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LI6EJgJ47pm
Name Naphtho[2,3-D]-1,3-dioxole, 5,6,7,8-tetrahydro-6,7-dimethyl-5-[4-(phenylmethoxy)phenyl]-, (5.alpha.,6.beta.,7.alpha.)-(.+-.)-
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 386.188194694 u
Formula C26H26O3
InChI InChI=1S/C26H26O3/c1-17-12-21-13-24-25(29-16-28-24)14-23(21)26(18(17)2)20-8-10-22(11-9-20)27-15-19-6-4-3-5-7-19/h3-11,13-14,17-18,26H,12,15-16H2,1-2H3/t17-,18+,26+/m0/s1
InChIKey XDJCEFWRUCMHOW-CUAXAMRHSA-N
Molecular Weight 386.491 g/mol
SMILES C12=C(C[C@@]([C@]([C@@]2(C=2C=CC(OCC=3C=CC=CC3)=CC2)[H])(C)[H])(C)[H])C=C2C(=C1)OCO2