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(3a.alpha.,5a.alpha.,8.beta.,8a.alpha.,8b.alpha.)-decahydro-8-methyl-2-oxo-2H-cyclopenta[de]-1-benzopyrane-4,4-di(methoxycarbonyl)

View entire compound with spectra: 1 MS (GC)

(3a.alpha.,5a.alpha.,8.beta.,8a.alpha.,8b.alpha.)-decahydro-8-methyl-2-oxo-2H-cyclopenta[de]-1-benzopyrane-4,4-di(methoxycarbonyl)
SpectraBase Compound ID BRqZuFhEZt
InChI InChI=1S/C16H22O6/c1-8-4-5-9-7-16(14(18)20-2,15(19)21-3)10-6-11(17)22-13(8)12(9)10/h8-10,12-13H,4-7H2,1-3H3/t8-,9-,10-,12-,13-/m1/s1
InChIKey CIVHXVQSJSUTAD-AIPRNEOBSA-N
Mol Weight 310.35 g/mol
Molecular Formula C16H22O6
Exact Mass 310.141638 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID E3BMAUp21mq
Name (3a.alpha.,5a.alpha.,8.beta.,8a.alpha.,8b.alpha.)-decahydro-8-methyl-2-oxo-2H-cyclopenta[de]-1-benzopyrane-4,4-di(methoxycarbonyl)
Alternate Name(s) Dimethyl (3aR,5aR,8R,8aR,8bR)-8-methyl-2-oxodecahydro-4H-cyclopenta[de]chromene-4,4-dicarboxylate
CAS Registry Number 110027-78-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H22O6
InChI InChI=1S/C16H22O6/c1-8-4-5-9-7-16(14(18)20-2,15(19)21-3)10-6-11(17)22-13(8)12(9)10/h8-10,12-13H,4-7H2,1-3H3/t8-,9-,10-,12-,13-/m1/s1
InChIKey CIVHXVQSJSUTAD-AIPRNEOBSA-N
Molecular Weight 310.346 g/mol
SMILES C1([C@]2([C@@]3([C@]([C@](C)(CC[C@@]3(C1)[H])[H])([H])OC(C2)=O)[H])[H])(C(=O)OC)C(=O)OC
SPLASH splash10-0udi-1090000000-65f99fa2bf13539b9721
Source of Spectrum K-120-2013-25
Wiley ID 1311411