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Furo[4,3,2-ij][2]benzopyran-2,7-dione, 2a,3,4,6,8a,8b-hexahydro-6-methyl-5-(1,3,3-trimethylcyclohexyl)-, [2aR-[2a.alpha.,5(S*),6.alpha.,8a.alpha.,8b.alpha.]]-
SpectraBase Compound ID JObS9YLkut6
InChI InChI=1S/C20H28O4/c1-11-14-13(20(4)9-5-8-19(2,3)10-20)7-6-12-15(14)18(23-16(11)21)24-17(12)22/h11-12,15,18H,5-10H2,1-4H3/t11-,12-,15-,18?,20+/m1/s1
InChIKey CITWWGQNJPHWFE-ONGXTJTJSA-N
Mol Weight 332.44 g/mol
Molecular Formula C20H28O4
Exact Mass 332.198759 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B3fMImEX76O
Name Furo[4,3,2-ij][2]benzopyran-2,7-dione, 2a,3,4,6,8a,8b-hexahydro-6-methyl-5-(1,3,3-trimethylcyclohexyl)-, [2aR-[2a.alpha.,5(S*),6.alpha.,8a.alpha.,8b.alpha.]]-
Alternate Name(s) (2aR,6R,8aR,8bR)-6-methyl-5-[(1S)-1,3,3-trimethylcyclohexyl]-2a,3,4,6,8a,8b-hexahydrofuro[4,3,2-ij][2]benzopyran-2,7-dione Cadlinolide A
CAS Registry Number 130246-91-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H28O4
InChI InChI=1S/C20H28O4/c1-11-14-13(20(4)9-5-8-19(2,3)10-20)7-6-12-15(14)18(23-16(11)21)24-17(12)22/h11-12,15,18H,5-10H2,1-4H3/t11-,12-,15-,18?,20+/m1/s1
InChIKey CITWWGQNJPHWFE-ONGXTJTJSA-N
Molecular Weight 332.440 g/mol
SMILES C=12[C@@]3(C(OC([C@@]3(CCC1[C@@]1(CC(C)(C)CCC1)C)[H])=O)OC([C@@]2(C)[H])=O)[H]
SPLASH splash10-0api-9400000000-f9dd6c5bd72feeed7d9b
Source of Spectrum J-56-47-3
Wiley ID 1329629