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(3AS,5R,11BS)-5-METHYL-3,3A-DIHYDRO-2H-BENZO-[G]-FURO-[3,2-C]-ISOCHROMENE-2,6,11-(5H,11BH)-TRIONE
SpectraBase Compound ID 9OpwFEInkxa
InChI InChI=1S/C16H12O5/c1-7-12-13(16-10(20-7)6-11(17)21-16)15(19)9-5-3-2-4-8(9)14(12)18/h2-5,7,10,16H,6H2,1H3/t7-,10+,16-/m1/s1
InChIKey CLQWEHDPSOGFQR-GHTXELIDSA-N
Mol Weight 284.27 g/mol
Molecular Formula C16H12O5
Exact Mass 284.068473 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DbcgP2xKJbd
Name 2H-Furo[3,2-b]naphtho[2,3-d]pyran-2,6,11-trione, 3,3a,5,11b-tetrahydro-5-methyl-, (3a.alpha.,5.beta.,11b.alpha.)-
Alternate Name(s) (3aS,5R,11bS)-5-methyl-3,3a,5,11b-tetrahydro-2H-furo[3,2-b]naphtho[2,3-d]pyran-2,6,11-trione cis-3,3a,5,11b-tetrahydro-5-methyl-2H-furo[3,2-b]naphtho-[2,3-d]pyran-2,6,11-trione
CAS Registry Number 68070-03-1
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H12O5
InChI InChI=1S/C16H12O5/c1-7-12-13(16-10(20-7)6-11(17)21-16)15(19)9-5-3-2-4-8(9)14(12)18/h2-5,7,10,16H,6H2,1H3/t7-,10+,16-/m1/s1
InChIKey CLQWEHDPSOGFQR-GHTXELIDSA-N
Molecular Weight 284.267 g/mol
SMILES C12=C(C(=O)c3c(C2=O)cccc3)[C@@](C)(O[C@@]2([C@]1(OC(=O)C2)[H])[H])[H]
SPLASH splash10-001i-0090000000-01157b7f9483ea8e5604
Source of Spectrum KC-1990-884-12
Wiley ID 1287859