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3-.beta.-acetoxy-desoxo-achalensolide
SpectraBase Compound ID L218kOAvDom
InChI InChI=1S/C17H22O4/c1-8-5-16-14(10(3)17(19)21-16)6-13-9(2)15(7-12(8)13)20-11(4)18/h8,12,14-16H,3,5-7H2,1-2,4H3/t8-,12-,14?,15-,16-/m0/s1
InChIKey BTRWURHGBOXOJL-BSSKTIGGSA-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 3PgrcTnHSi
Name 3-.beta.-acetoxy-desoxo-achalensolide
Alternate Name(s) (6S,7aS,8S,9aS)-5,8-dimethyl-3-methylene-2-oxo-2,3,3a,4,6,7,7a,8,9,9a-decahydroazuleno[6,5-b]furan-6-yl acetate
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Formula C17H22O4
InChI InChI=1S/C17H22O4/c1-8-5-16-14(10(3)17(19)21-16)6-13-9(2)15(7-12(8)13)20-11(4)18/h8,12,14-16H,3,5-7H2,1-2,4H3/t8-,12-,14?,15-,16-/m0/s1
InChIKey BTRWURHGBOXOJL-BSSKTIGGSA-N
Molecular Weight 290.359 g/mol
SMILES C12=C([C@@](OC(=O)C)(C[C@]2([C@](C[C@@]2(OC(C(C2C1)=C)=O)[H])(C)[H])[H])[H])C
SPLASH splash10-0002-2970000000-0a72c81f35474fb63370
Source of Spectrum LQ-1992-52-0
Wiley ID 1293708