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(4a,6,6-Trimethyl-8-oxo-4,4a,5,6,7,8,9,9a-octahydro-1H-xanthene-2,3-diyl)bis(methylene) Diacetate
SpectraBase Compound ID KdmVJBg48EO
InChI InChI=1S/C22H30O6/c1-13(23)26-11-15-6-17-7-18-19(25)9-21(3,4)10-20(18)28-22(17,5)8-16(15)12-27-14(2)24/h17H,6-12H2,1-5H3/t17-,22-/m0/s1
InChIKey UDAGEJKRVJKGBY-JTSKRJEESA-N
Mol Weight 390.48 g/mol
Molecular Formula C22H30O6
Exact Mass 390.204239 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GZBn9Vz5Vxa
Name (4a,6,6-Trimethyl-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 C22H30O6
InChI InChI=1S/C22H30O6/c1-13(23)26-11-15-6-17-7-18-19(25)9-21(3,4)10-20(18)28-22(17,5)8-16(15)12-27-14(2)24/h17H,6-12H2,1-5H3/t17-,22-/m0/s1
InChIKey UDAGEJKRVJKGBY-JTSKRJEESA-N
Molecular Weight 390.476 g/mol
SMILES C12=C(O[C@]3(CC(COC(=O)C)=C(C[C@]3(C2)[H])COC(=O)C)C)CC(CC1=O)(C)C
SPLASH splash10-00di-2790000000-bd632b02c3d9e08dab3e
Source of Spectrum F4-43-976-5d
Synonyms Acetic acid (4S,4aS)-2-acetoxymethyl-4a,6,6-trimethyl-8-oxo-4,4a,5,6,7,8,9,9a-octahydro-1H-xanthen-3-ylmethyl ester
Wiley ID 1675589