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(1S,8aS.2'R)-2',3'-O-Bisacetylglycerol 2,5,5,8a-Tetramethyl-1,4,5,6,7,8-hexahydronaphthalene-1-carboxylate
SpectraBase Compound ID J8eC5SYHG4m
InChI InChI=1S/C21H34O4/c1-14-8-9-16-19(2,3)10-7-11-21(16,6)17(14)18(22)23-12-15-13-24-20(4,5)25-15/h8,15-17H,7,9-13H2,1-6H3/t15-,16?,17-,21+/m1/s1
InChIKey WCHDBBNRIQGHOV-BRZGIBKSSA-N
Mol Weight 350.5 g/mol
Molecular Formula C21H34O4
Exact Mass 350.24571 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CGq9qL0pljL
Name (1S,8aS.2'R)-2',3'-O-Bisacetylglycerol 2,5,5,8a-Tetramethyl-1,4,5,6,7,8-hexahydronaphthalene-1-carboxylate
Alternate Name(s) (1S,8aS.2'S)-2',3'-O-Bisacetylglycerol 2,5,5,8a-Tetramethyl-1,4,5,6,7,8-hexahydronaphthalene-1-carboxylate 1,2-O-Isopropylideneglycerol 2,5,5,8a-Tetramethyl-1,4,5,6,7,8-hexahydronaphthalene-1-carboxylate [(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]methyl (1S,8aS)-2,5,5,8a-tetramethyl-1,4,4a,5,6,7,8,8a-octahydro-1-naphthalenecarboxylate
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Formula C21H34O4
InChI InChI=1S/C21H34O4/c1-14-8-9-16-19(2,3)10-7-11-21(16,6)17(14)18(22)23-12-15-13-24-20(4,5)25-15/h8,15-17H,7,9-13H2,1-6H3/t15-,16?,17-,21+/m1/s1
InChIKey WCHDBBNRIQGHOV-BRZGIBKSSA-N
Molecular Weight 350.499 g/mol
SMILES [C@]12([C@@](C(OC[C@]3(OC(C)(C)OC3)[H])=O)(C(C)=CCC1C(C)(C)CCC2)[H])C
SPLASH splash10-00ko-0294000000-e8e05f100ad24d0adbe5
Source of Spectrum QC-10-1267-2
Wiley ID 871301