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(7E,9E)-(5aS,11aS)-5a-Methyl-1-oxo-2,3,4,5a,6,11,11a,12-octahydro-1H-5-oxa-cycloocta[b]naphthalene-8,9-dicarboxylic acid dimethyl ester
SpectraBase Compound ID IXWPH07afIb
InChI InChI=1S/C20H24O6/c1-20-10-9-14(19(23)25-3)13(18(22)24-2)8-7-12(20)11-15-16(21)5-4-6-17(15)26-20/h8-9,12H,4-7,10-11H2,1-3H3/b13-8+,14-9+/t12-,20-/m0/s1
InChIKey BZTLQUGIQXNPPH-ZHKGDMBWSA-N
Mol Weight 360.41 g/mol
Molecular Formula C20H24O6
Exact Mass 360.157288 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4Ugw99sUZzy
Name (7E,9E)-(5aS,11aS)-5a-Methyl-1-oxo-2,3,4,5a,6,11,11a,12-octahydro-1H-5-oxa-cycloocta[b]naphthalene-8,9-dicarboxylic acid dimethyl ester
Alternate Name(s) Dimethyl (7E,9E)-5a-Methyl-1-oxo-2,3,4,5a,6,11,11a,12-octahydro-1H-cycloocta[b]chromene-8,9-dicarboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H24O6
InChI InChI=1S/C20H24O6/c1-20-10-9-14(19(23)25-3)13(18(22)24-2)8-7-12(20)11-15-16(21)5-4-6-17(15)26-20/h8-9,12H,4-7,10-11H2,1-3H3/b13-8+,14-9+/t12-,20-/m0/s1
InChIKey BZTLQUGIQXNPPH-ZHKGDMBWSA-N
Molecular Weight 360.406 g/mol
SMILES C12=C(O[C@@]3([C@](C2)(C\C=C\(C(=O)OC)\C(=C/C3)C(=O)OC)[H])C)CCCC1=O
SPLASH splash10-01t9-3933000000-695d70bcae37c3c6fbaa
Source of Spectrum F4-43-977-6a
Wiley ID 1675585