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(3aR,4S,5R,6R,7aR)-4,5-bis(phenylmethoxy)-6-(phenylmethoxymethyl)spiro[3a,4,5,6,7,7a-hexahydro-1,3-benzodioxole-2,1'-cyclohexane]

View entire compound with spectra: 1 MS (GC)

(3aR,4S,5R,6R,7aR)-4,5-bis(phenylmethoxy)-6-(phenylmethoxymethyl)spiro[3a,4,5,6,7,7a-hexahydro-1,3-benzodioxole-2,1'-cyclohexane]
SpectraBase Compound ID 5kPFnMObhMj
InChI InChI=1S/C34H40O5/c1-5-13-26(14-6-1)22-35-25-29-21-30-32(39-34(38-30)19-11-4-12-20-34)33(37-24-28-17-9-3-10-18-28)31(29)36-23-27-15-7-2-8-16-27/h1-3,5-10,13-18,29-33H,4,11-12,19-25H2/t29-,30-,31-,32-,33+/m1/s1
InChIKey IPDUDDWGACLMMS-UPYFENACSA-N
Mol Weight 528.7 g/mol
Molecular Formula C34H40O5
Exact Mass 528.287574 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HHxNfaM3NXJ
Name (3aR,4S,5R,6R,7aR)-4,5-bis(phenylmethoxy)-6-(phenylmethoxymethyl)spiro[3a,4,5,6,7,7a-hexahydro-1,3-benzodioxole-2,1'-cyclohexane]
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Formula C34H40O5
InChI InChI=1S/C34H40O5/c1-5-13-26(14-6-1)22-35-25-29-21-30-32(39-34(38-30)19-11-4-12-20-34)33(37-24-28-17-9-3-10-18-28)31(29)36-23-27-15-7-2-8-16-27/h1-3,5-10,13-18,29-33H,4,11-12,19-25H2/t29-,30-,31-,32-,33+/m1/s1
InChIKey IPDUDDWGACLMMS-UPYFENACSA-N
Molecular Weight 528.689 g/mol
SMILES [C@@]12([C@]([C@](OCc3ccccc3)([C@](C[C@]1(OC1(O2)CCCCC1)[H])(COCc1ccccc1)[H])[H])(OCc1ccccc1)[H])[H]
SPLASH splash10-0006-9000000000-8da4d1086dbdd6d7a3f0
Source of Spectrum KC-0-2021-12
Synonyms (3aR,4S,5R,6R,7aR)-4,5-dibenzoxy-6-(benzoxymethyl)spiro[3a,4,5,6,7,7a-hexahydro-1,3-benzodioxole-2,1'-cyclohexane] (3aR,4S,5R,6R,7aR)-4,5-dibenzyloxy-6-(benzyloxymethyl)spiro[3a,4,5,6,7,7a-hexahydro-1,3-benzodioxole-2,1'-cyclohexane]
Wiley ID 781676