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8beta-ethyl-1,6,7beta,8alpha-tetrahydroxy-7,8,9,10-tetrahydronaphthacene-5,12-dione
SpectraBase Compound ID 9ifpEnV002R
InChI InChI=1S/C20H18O6/c1-2-20(26)7-6-9-8-11-15(18(24)13(9)19(20)25)16(22)10-4-3-5-12(21)14(10)17(11)23/h3-5,8,19,21,24-26H,2,6-7H2,1H3/t19-,20-/m1/s1
InChIKey YUBPRQYIYMCBKK-WOJBJXKFSA-N
Mol Weight 354.36 g/mol
Molecular Formula C20H18O6
Exact Mass 354.110338 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4vNelZJxbI7
Name 8beta-ethyl-1,6,7beta,8alpha-tetrahydroxy-7,8,9,10-tetrahydronaphthacene-5,12-dione
Alternate Name(s) (7R,8R)-8-ethyl-1,6,7,8-tetrahydroxy-7,8,9,10-tetrahydro-5,12-naphthacenedione 8.beta.-ethyl-1,6,7beta,8.alpha.-tetrahydroxy-7,8,9,10-tetrahydronaphthacene-5,12-dione
CAS Registry Number 79036-55-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H18O6
InChI InChI=1S/C20H18O6/c1-2-20(26)7-6-9-8-11-15(18(24)13(9)19(20)25)16(22)10-4-3-5-12(21)14(10)17(11)23/h3-5,8,19,21,24-26H,2,6-7H2,1H3/t19-,20-/m1/s1
InChIKey YUBPRQYIYMCBKK-WOJBJXKFSA-N
Molecular Weight 354.358 g/mol
SMILES Oc1cccc2c1C(c1c(c(c3[C@]([C@@](CCc3c1)(O)CC)(O)[H])O)C2=O)=O
SPLASH splash10-0zi9-0098000000-0230a03381132e1a2d2d
Source of Spectrum W5-1989-25126-1
Wiley ID 1344565