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4,9-Epoxynaphtho[2,3-c]furan-1,3-dione, 3a,4,9,9a-tetrahydro-3a,9a-dimethyl-, (3a.alpha.,4.alpha.,9.alpha.,9a.alpha.)-
SpectraBase Compound ID 1LOkH4kmoUL
InChI InChI=1S/C14H12O4/c1-13-9-7-5-3-4-6-8(7)10(17-9)14(13,2)12(16)18-11(13)15/h3-6,9-10H,1-2H3/t9-,10+,13-,14+
InChIKey FJDBOPOHCNHIFM-IOQCUFBNSA-N
Mol Weight 244.25 g/mol
Molecular Formula C14H12O4
Exact Mass 244.073559 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6qDc8vYANVJ
Name 4,9-Epoxynaphtho[2,3-c]furan-1,3-dione, 3a,4,9,9a-tetrahydro-3a,9a-dimethyl-, (3a.alpha.,4.alpha.,9.alpha.,9a.alpha.)-
Alternate Name(s) (1R,8S,9S,13R)-9,13-dimethyl-11,14-dioxatetracyclo[6.5.1.0(2,7).0(9,13)]tetradeca-2,4,6-triene-10,12-dione Isobenzocantharidin
CAS Registry Number 82838-30-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H12O4
InChI InChI=1S/C14H12O4/c1-13-9-7-5-3-4-6-8(7)10(17-9)14(13,2)12(16)18-11(13)15/h3-6,9-10H,1-2H3/t9-,10+,13-,14+
InChIKey FJDBOPOHCNHIFM-IOQCUFBNSA-N
Molecular Weight 244.246 g/mol
SMILES [C@@]12([C@@](C(=O)OC2=O)([C@]2([H])O[C@]1(c1c2cccc1)[H])C)C
SPLASH splash10-014i-0900000000-9a5417a7876205a126d3
Source of Spectrum J-47-4012-0
Wiley ID 1247061