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8-Methoxy-5,8-dimethyl-4-(3-benzyloxyprop-2-yl)-3,7-dioxabicyclo[4.3.0]nonan-2-one isomer
SpectraBase Compound ID B4rjTCOwdZ9
InChI InChI=1S/C20H28O5/c1-13(11-23-12-15-8-6-5-7-9-15)17-14(2)18-16(19(21)24-17)10-20(3,22-4)25-18/h5-9,13-14,16-18H,10-12H2,1-4H3/t13-,14+,16-,17+,18-,20+/m1/s1
InChIKey JCQQHOKRUSJLED-VCVLNCAMSA-N
Mol Weight 348.44 g/mol
Molecular Formula C20H28O5
Exact Mass 348.193674 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CE7BOXoyK3b
Name 8-Methoxy-5,8-dimethyl-4-(3-benzyloxyprop-2-yl)-3,7-dioxabicyclo[4.3.0]nonan-2-one isomer
Alternate Name(s) (2S,3aR,6S,7R,7aR)-6-[(1R)-2-benzyloxy-1-methyl-ethyl]-2-methoxy-2,7-dimethyl-3a,6,7,7a-tetrahydro-3H-furo[3,2-c]pyran-4-one (2S,3aR,6S,7R,7aR)-2-methoxy-2,7-dimethyl-6-[(2R)-1-phenylmethoxypropan-2-yl]-3a,6,7,7a-tetrahydro-3H-furo[3,2-c]pyran-4-one
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Formula C20H28O5
InChI InChI=1S/C20H28O5/c1-13(11-23-12-15-8-6-5-7-9-15)17-14(2)18-16(19(21)24-17)10-20(3,22-4)25-18/h5-9,13-14,16-18H,10-12H2,1-4H3/t13-,14+,16-,17+,18-,20+/m1/s1
InChIKey JCQQHOKRUSJLED-VCVLNCAMSA-N
Molecular Weight 348.439 g/mol
SMILES [C@@]12([C@@]([C@@](C)([C@@](OC2=O)([C@@](COCc2ccccc2)(C)[H])[H])[H])(O[C@@](C1)(OC)C)[H])[H]
SPLASH splash10-015c-9206000000-df624018780add33aba4
Source of Spectrum J-67-1758-16
Wiley ID 1569218