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Methyl (1b,5aa,6a,9ab)-6-methoxymethyloxy-5a-methyl-3-oxodecahydro-2-benzoxepine-1-carboxylate
SpectraBase Compound ID 7F9bXYjzCPO
InChI InChI=1S/C15H24O6/c1-15-8-7-12(16)21-13(14(17)19-3)10(15)5-4-6-11(15)20-9-18-2/h10-11,13H,4-9H2,1-3H3/t10-,11-,13+,15-/m1/s1
InChIKey JKQBSJMJCLDCNZ-UQFNBPPOSA-N
Mol Weight 300.35 g/mol
Molecular Formula C15H24O6
Exact Mass 300.157288 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JRsF8vEyvB6
Name Methyl (1b,5aa,6a,9ab)-6-methoxymethyloxy-5a-methyl-3-oxodecahydro-2-benzoxepine-1-carboxylate
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Formula C15H24O6
InChI InChI=1S/C15H24O6/c1-15-8-7-12(16)21-13(14(17)19-3)10(15)5-4-6-11(15)20-9-18-2/h10-11,13H,4-9H2,1-3H3/t10-,11-,13+,15-/m1/s1
InChIKey JKQBSJMJCLDCNZ-UQFNBPPOSA-N
Molecular Weight 300.351 g/mol
SMILES [C@]12([C@@]([C@](OC(CC2)=O)(C(=O)OC)[H])(CCC[C@]1(OCOC)[H])[H])C
SPLASH splash10-0a4i-9100000000-a57f8928e0dff64f2c01
Source of Spectrum B-48-609-0
Synonyms Methyl (1R,5aS,6S,9aR)-6-(methoxymethoxy)-5a-methyl-3-oxodecahydro-2-benzoxepin-1-carboxylate (1S,5aR,6R,9aS)-6-(methoxymethoxy)-5a-methyl-3-oxo-1,4,5,6,7,8,9,9a-octahydrobenzo[c]oxepin-1-carboxylic acid methyl ester Methyl (1S,5aR,6R,9aS)-6-(methoxymethoxy)-5a-methyl-3-oxo-1,4,5,6,7,8,9,9a-octahydrobenzo[c]oxepine-1-carboxylate Methyl (1S,5aR,6R,9aS)-6-(methoxymethoxy)-5a-methyl-3-oxidanylidene-1,4,5,6,7,8,9,9a-octahydrobenzo[c]oxepine-1-carboxylate
Wiley ID 1302642