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(1.alpha.,2.alpha.,9E,11E,19.alpha.,20.alpha.)-22-oxatetracyclo[18.3.0.0(2,10).0(11,19)]tricosa-9(E),11(E)-9,11-diene-21,23-dione
SpectraBase Compound ID 2YoYv3XD3ar
InChI InChI=1S/C22H30O3/c23-21-19-17-13-9-5-1-3-7-11-15(17)16-12-8-4-2-6-10-14-18(16)20(19)22(24)25-21/h11-12,17-20H,1-10,13-14H2/b15-11-,16-12-/t17-,18+,19-,20+
InChIKey YHEHKFJKICVBJR-DOIKNUJESA-N
Mol Weight 342.48 g/mol
Molecular Formula C22H30O3
Exact Mass 342.219495 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5FiGJYx9jE
Name (1.alpha.,2.alpha.,9E,11E,19.alpha.,20.alpha.)-22-oxatetracyclo[18.3.0.0(2,10).0(11,19)]tricosa-9(E),11(E)-9,11-diene-21,23-dione
CAS Registry Number 129731-97-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H30O3
InChI InChI=1S/C22H30O3/c23-21-19-17-13-9-5-1-3-7-11-15(17)16-12-8-4-2-6-10-14-18(16)20(19)22(24)25-21/h11-12,17-20H,1-10,13-14H2/b15-11-,16-12-/t17-,18+,19-,20+
InChIKey YHEHKFJKICVBJR-DOIKNUJESA-N
Molecular Weight 342.479 g/mol
SMILES C1([C@]2([C@@]([C@]3(CCCCCC\C=C/3\C=3[C@]2(CCCCCCC/3)[H])[H])([H])C(O1)=O)[H])=O
SPLASH splash10-01ox-0019000000-8c3cb0347295e970b525
Source of Spectrum K-124-153-6
Synonyms (3aR,3bS,17aR,17bS)-3a,3b,4,5,6,7,8,9,12,13,14,15,16,17,17a,17b-hexadecahydrodicyclonona[e,g][2]benzofuran-1,3-dione
Wiley ID 1336935