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2-[(5R,6S,7aS)-3,6-dimethyl- 2-oxo-6-vinyl-2,4,5,6,7,7a-hexahydro-1-benzofuran-5-yl]- prop-2-en-1-yl acetate
SpectraBase Compound ID 4kJCEsctiv4
InChI InChI=1S/C17H22O4/c1-5-7-20-15(18)9-12-8-13-11(3)16(19)21-14(13)10-17(12,4)6-2/h5-6,12,14H,1-2,7-10H2,3-4H3/t12-,14+,17-/m1/s1
InChIKey SNHHJKDLBGCVHV-HACGYAERSA-N
Mol Weight 290.36 g/mol
Molecular Formula C17H22O4
Exact Mass 290.151809 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5C59Xl2NH6
Name 2-[(5R,6S,7aS)-3,6-dimethyl- 2-oxo-6-vinyl-2,4,5,6,7,7a-hexahydro-1-benzofuran-5-yl]- prop-2-en-1-yl acetate
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Formula C17H22O4
InChI InChI=1S/C17H22O4/c1-5-7-20-15(18)9-12-8-13-11(3)16(19)21-14(13)10-17(12,4)6-2/h5-6,12,14H,1-2,7-10H2,3-4H3/t12-,14+,17-/m1/s1
InChIKey SNHHJKDLBGCVHV-HACGYAERSA-N
Molecular Weight 290.359 g/mol
SMILES C(C[C@]1(CC2=C(C(O[C@]2(C[C@]1(C=C)C)[H])=O)C)[H])(=O)OCC=C
SPLASH splash10-0a4r-0910000000-ca447ef4b623051b89ea
Source of Spectrum Solomon K.S. Amoah, et al. Phytochemistry, V.87, 2013, P.126-132
Synonyms Allyl 2-((5R,6S,7aS)-3,6-dimethyl-2-oxo-6-vinyl-2,4,5,6,7,7a-hexahydrobenzofuran-5-yl)acetate
Wiley ID 1816867