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Methyl (1R,2R,3S,5S,6S)-3-[3-Acetoxy-5-isopropenyl-2-methyl-8-oxo-7-oxabicyclo[4.3.0]non-2-yl]propionate
SpectraBase Compound ID Hb76TMF57j8
InChI InChI=1S/C18H26O6/c1-10(2)12-8-14(23-11(3)19)18(4,7-6-15(20)22-5)13-9-16(21)24-17(12)13/h12-14,17H,1,6-9H2,2-5H3/t12-,13-,14-,17-,18+/m0/s1
InChIKey QJPPOKZLLXPDQS-TZUPDSNESA-N
Mol Weight 338.4 g/mol
Molecular Formula C18H26O6
Exact Mass 338.172939 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GfFnog5qdiA
Name Methyl (1R,2R,3S,5S,6S)-3-[3-Acetoxy-5-isopropenyl-2-methyl-8-oxo-7-oxabicyclo[4.3.0]non-2-yl]propionate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H26O6
InChI InChI=1S/C18H26O6/c1-10(2)12-8-14(23-11(3)19)18(4,7-6-15(20)22-5)13-9-16(21)24-17(12)13/h12-14,17H,1,6-9H2,2-5H3/t12-,13-,14-,17-,18+/m0/s1
InChIKey QJPPOKZLLXPDQS-TZUPDSNESA-N
Molecular Weight 338.400 g/mol
SMILES [C@@]12([C@@]([C@](CCC(=O)OC)(C)[C@](C[C@]2(C(=C)C)[H])(OC(=O)C)[H])(CC(O1)=O)[H])[H]
SPLASH splash10-01r2-3980000000-2a82a73a1969e2a08e73
Source of Spectrum AJ-65-2425-22
Synonyms Methyl 3-[(3aR,4R,5S,7S,7aS)-5-(acetyloxy)-7-isopropenyl-4-methyl-2-oxooctahydro-1-benzofuran-4-yl]propanoate
Wiley ID 771679