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Methyl (4aR,5R,6S,8aS)-2,5,8a-Trimethyl-6-(benzyloxy)-5-(benzyloxymethyl)-3,4,4a,5,6,7,8,8a-octahydronaphthalene-1-carboxylate

View entire compound with spectra: 1 MS (GC)

Methyl (4aR,5R,6S,8aS)-2,5,8a-Trimethyl-6-(benzyloxy)-5-(benzyloxymethyl)-3,4,4a,5,6,7,8,8a-octahydronaphthalene-1-carboxylate
SpectraBase Compound ID 3wV7PP7MsWS
InChI InChI=1S/C30H38O4/c1-22-15-16-25-29(2,27(22)28(31)32-4)18-17-26(34-20-24-13-9-6-10-14-24)30(25,3)21-33-19-23-11-7-5-8-12-23/h5-14,25-26H,15-21H2,1-4H3/t25-,26-,29-,30-/m0/s1
InChIKey PRDDZYFXMKMAAC-ATACATFBSA-N
Mol Weight 462.6 g/mol
Molecular Formula C30H38O4
Exact Mass 462.27701 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IuLSKCHSBBn
Name Methyl (4aR,5R,6S,8aS)-2,5,8a-Trimethyl-6-(benzyloxy)-5-(benzyloxymethyl)-3,4,4a,5,6,7,8,8a-octahydronaphthalene-1-carboxylate
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Formula C30H38O4
InChI InChI=1S/C30H38O4/c1-22-15-16-25-29(2,27(22)28(31)32-4)18-17-26(34-20-24-13-9-6-10-14-24)30(25,3)21-33-19-23-11-7-5-8-12-23/h5-14,25-26H,15-21H2,1-4H3/t25-,26-,29-,30-/m0/s1
InChIKey PRDDZYFXMKMAAC-ATACATFBSA-N
Molecular Weight 462.630 g/mol
SMILES [C@@]12(C(C(=O)OC)=C(C)CC[C@@]2([C@@](COCc2ccccc2)(C)[C@](CC1)(OCc1ccccc1)[H])[H])C
SPLASH splash10-0006-9050100000-a3fc93d289f7cba87b01
Source of Spectrum KC-0-3320-2
Synonyms Methyl (4aS,5R,6S,8aS)-)-2,5,8a-Trimethyl-6-(benzyloxy)-5-(benzyloxymethyl)-3,4,4a,5,6,7,8,8a-octahydronaphthalene-1-carboxylate Methyl (4aS,5R,6S,8aS)-6-(benzyloxy)-5-[(benzyloxy)methyl]-2,5,8a-trimethyl-3,4,4a,5,6,7,8,8a-octahydro-1-naphthalenecarboxylate
Wiley ID 829412