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(4a-Methyl-8-oxo-4,4a,5,6,7,8,9,9a-octahydro-1H-xanthene-2,3-diyl)bis(methylene) Diacetate
SpectraBase Compound ID 7khyDmVfWoQ
InChI InChI=1S/C20H26O6/c1-12(21)24-10-14-7-16-8-17-18(23)5-4-6-19(17)26-20(16,3)9-15(14)11-25-13(2)22/h16H,4-11H2,1-3H3/t16-,20-/m0/s1
InChIKey CEELSCMWDWRVBH-JXFKEZNVSA-N
Mol Weight 362.42 g/mol
Molecular Formula C20H26O6
Exact Mass 362.172939 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6Gk6YKXL3lO
Name (4a-Methyl-8-oxo-4,4a,5,6,7,8,9,9a-octahydro-1H-xanthene-2,3-diyl)bis(methylene) Diacetate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H26O6
InChI InChI=1S/C20H26O6/c1-12(21)24-10-14-7-16-8-17-18(23)5-4-6-19(17)26-20(16,3)9-15(14)11-25-13(2)22/h16H,4-11H2,1-3H3/t16-,20-/m0/s1
InChIKey CEELSCMWDWRVBH-JXFKEZNVSA-N
Molecular Weight 362.422 g/mol
SMILES C12=C(O[C@]3(CC(COC(=O)C)=C(C[C@]3(C2)[H])COC(=O)C)C)CCCC1=O
SPLASH splash10-0006-3980000000-9fc6b66ac002eb0d2e89
Source of Spectrum F4-43-976-5c
Synonyms Acetic acid (4S,4aS)-2-acetoxymethyl-4a-methyl-8-oxo-4,4a,5,6,7,8,9,9a-octahydro-1H-xanthen-3-ylmethyl ester
Wiley ID 1675590