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(11S)-3.alpha.-acetoxyguaia-4(15),10(14)-dieno-12,6.alpha.-lactone
SpectraBase Compound ID HKJdVToRJ5x
InChI InChI=1S/C17H22O4/c1-8-5-6-12-9(2)17(19)21-16(12)15-10(3)14(7-13(8)15)20-11(4)18/h9,12-16H,1,3,5-7H2,2,4H3/t9-,12-,13+,14?,15?,16?/m1/s1
InChIKey SQNNWZYJAHLOGG-OCKLLJGQSA-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 FpjxLESs69i
Name (11S)-3.alpha.-acetoxyguaia-4(15),10(14)-dieno-12,6.alpha.-lactone
Alternate Name(s) (3R,3aR,6aR,8S)-3-methyl-6,9-dimethylene-2-oxododecahydroazuleno[4,5-b]furan-8-yl acetate
CAS Registry Number 82206-89-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H22O4
InChI InChI=1S/C17H22O4/c1-8-5-6-12-9(2)17(19)21-16(12)15-10(3)14(7-13(8)15)20-11(4)18/h9,12-16H,1,3,5-7H2,2,4H3/t9-,12-,13+,14?,15?,16?/m1/s1
InChIKey SQNNWZYJAHLOGG-OCKLLJGQSA-N
Molecular Weight 290.359 g/mol
SMILES C12C3OC(=O)[C@@]([C@]3(CCC([C@@]1(CC(C2=C)OC(=O)C)[H])=C)[H])(C)[H]
SPLASH splash10-052b-1390000000-f1252c0e30c2aa4b2f9f
Source of Spectrum J-54-1957-30
Wiley ID 1293732