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1,4-Methanonaphthalene-5,8-dione, 1,4,4a,8a-tetrahydro-6,7-dimethoxy-4a-methyl-, (1.alpha.,4.alpha.,4a.alpha.,8a.alpha.)-(.+-.)-
SpectraBase Compound ID A8pN4pnUvxG
InChI InChI=1S/C14H16O4/c1-14-8-5-4-7(6-8)9(14)10(15)11(17-2)12(18-3)13(14)16/h4-5,7-9H,6H2,1-3H3/t7-,8+,9+,14+/m0/s1
InChIKey IXWCWIVRHATZNI-FSEIGPPCSA-N
Mol Weight 248.28 g/mol
Molecular Formula C14H16O4
Exact Mass 248.104859 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FT487yWHpkP
Name 1,4-Methanonaphthalene-5,8-dione, 1,4,4a,8a-tetrahydro-6,7-dimethoxy-4a-methyl-, (1.alpha.,4.alpha.,4a.alpha.,8a.alpha.)-(.+-.)-
CAS Registry Number 130697-14-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H16O4
InChI InChI=1S/C14H16O4/c1-14-8-5-4-7(6-8)9(14)10(15)11(17-2)12(18-3)13(14)16/h4-5,7-9H,6H2,1-3H3/t7-,8+,9+,14+/m0/s1
InChIKey IXWCWIVRHATZNI-FSEIGPPCSA-N
Molecular Weight 248.278 g/mol
SMILES [C@]12(C(C(OC)=C(C([C@]2([C@]2([H])C[C@]1(C=C2)[H])[H])=O)OC)=O)C
SPLASH splash10-014r-8920000000-43c32ff10c71a0991614
Source of Spectrum H-73-794-7
Synonyms (1S,2R,7S,8R)-4,5-dimethoxy-2-methyltricyclo[6.2.1.0(2,7)]undeca-4,9-diene-3,6-dione rac-1,4,4a,8a.alpha.-tetrahydro-6,7-dimethoxy-1a.alpha.-methyl-1.alpha.,4.alpha.-methanonaphthapene
Wiley ID 1251069