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Xeniolide C

View entire compound with spectra: 1 MS (GC)

Xeniolide C
SpectraBase Compound ID 27okm2dlNGD
InChI InChI=1S/C22H30O4/c1-14(2)21(26-17(5)23)12-11-19-18-10-9-15(3)7-6-8-16(4)20(18)13-25-22(19)24/h7,11,18,20-21H,1,4,6,8-10,12-13H2,2-3,5H3/b15-7+,19-11+/t18-,20+,21?/m1/s1
InChIKey ZQNYFJWSDUYQGB-DSQDWKGWSA-N
Mol Weight 358.48 g/mol
Molecular Formula C22H30O4
Exact Mass 358.214409 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5mVXqPi2gFf
Name Xeniolide C
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H30O4
InChI InChI=1S/C22H30O4/c1-14(2)21(26-17(5)23)12-11-19-18-10-9-15(3)7-6-8-16(4)20(18)13-25-22(19)24/h7,11,18,20-21H,1,4,6,8-10,12-13H2,2-3,5H3/b15-7+,19-11+/t18-,20+,21?/m1/s1
InChIKey ZQNYFJWSDUYQGB-DSQDWKGWSA-N
Molecular Weight 358.478 g/mol
SMILES [C@@]12(\C(C(OC[C@]2(C(=C)CC\C=C\(CC1)C)[H])=O)=C/CC(OC(=O)C)C(=C)C)[H]
SPLASH splash10-0007-9330000000-40fa0ce2ef947b1eedd2
Source of Spectrum G4-60-892-8
Synonyms 1-[(2E)-2-((4aS,11aR)-7-methyl-11-methylene-3-oxo-1,4a,5,6,9,10,11,11a-octahydrocyclonona[c]pyran-4(3H)-ylidene)ethyl]-2-methyl-2-propenyl acetate Acetic acid[(5E)-5-[(4aS,7E,11aR)-7-methyl-11-methylene-3-oxo-4a,5,6,9,10,11a-hexahydro-1H-cyclonona[c]pyran-4-ylidene]-2-methylpent-1-en-3-yl]ester Acetic acid[1-[(2E)-2-[(4aS,7E,11aR)-3-keto-7-methyl-11-methylene-4a,5,6,9,10,11a-hexahydro-1H-cyclonona[c]pyran-4-ylidene]ethyl]-2-methyl-allyl]ester [(5E)-5-[(4aS,7E,11aR)-7-methyl-11-methylidene-3-oxidanylidene-4a,5,6,9,10,11a-hexahydro-1H-cyclonona[c]pyran-4-ylidene]-2-methyl-pent-1-en-3-yl]ethanoate [(5E)-5-[(4aS,7E,11aR)-7-methyl-11-methylidene-3-oxo-4a,5,6,9,10,11a-hexahydro-1H-cyclonona[c]pyran-4-ylidene]-2-methylpent-1-en-3-yl]acetate [1-[(2E)-2-[(4aS,7E,11aR)-7-methyl-11-methylene-3-oxo-4a,5,6,9,10,11a-hexahydro-1H-cyclonona[c]pyran-4-ylidene]ethyl]-2-methyl-allyl]acetate Acetic acid [(5E)-5-[(4aS,7E,11aR)-7-methyl-11-methylene-3-oxo-4a,5,6,9,10,11a-hexahydro-1H-cyclonona[c]pyran-4-ylidene]-2-methylpent-1-en-3-yl] ester [(5E)-5-[(4aS,7E,11aR)-7-methyl-11-methylidene-3-oxo-4a,5,6,9,10,11a-hexahydro-1H-cyclonona[c]pyran-4-ylidene]-2-methylpent-1-en-3-yl] acetate [1-[(2E)-2-[(4aS,7E,11aR)-7-methyl-11-methylene-3-oxo-4a,5,6,9,10,11a-hexahydro-1H-cyclonona[c]pyran-4-ylidene]ethyl]-2-methyl-allyl] acetate [(5E)-5-[(4aS,7E,11aR)-7-methyl-11-methylidene-3-oxidanylidene-4a,5,6,9,10,11a-hexahydro-1H-cyclonona[c]pyran-4-ylidene]-2-methyl-pent-1-en-3-yl] ethanoate
Wiley ID 1606821