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Furano-cembranoid - acetyl derivative
SpectraBase Compound ID 6oq0pZejylz
InChI InChI=1S/C24H30O9/c1-13(2)15-7-8-17(22(27)30-5)21(32-14(3)25)19(26)12-24(4,29)11-16-10-18(23(28)31-6)20(9-15)33-16/h8,10,15,21,29H,1,7,9,11-12H2,2-6H3/b17-8+/t15-,21?,24+/m0/s1
InChIKey HNAPVDUBZKDCHC-SUFSGPMRSA-N
Mol Weight 462.5 g/mol
Molecular Formula C24H30O9
Exact Mass 462.188983 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Jkxp2zoB0zM
Name Furano-cembranoid - acetyl derivative
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H30O9
InChI InChI=1S/C24H30O9/c1-13(2)15-7-8-17(22(27)30-5)21(32-14(3)25)19(26)12-24(4,29)11-16-10-18(23(28)31-6)20(9-15)33-16/h8,10,15,21,29H,1,7,9,11-12H2,2-6H3/b17-8+/t15-,21?,24+/m0/s1
InChIKey HNAPVDUBZKDCHC-SUFSGPMRSA-N
Molecular Weight 462.495 g/mol
SMILES O[C@]1(CC(C(OC(=O)C)\C(=C/C[C@@](Cc2c(cc(C1)o2)C(=O)OC)(C(=C)C)[H])C(=O)OC)=O)C
SPLASH splash10-066r-0960100000-af0984ffa9c701cef767
Source of Spectrum X2-56-972-2
Synonyms 1,7-bis(Methoxycarbonyl)-4-(1'-methylethenyl)-8-acetoxy-11-hydroxy-9-oxo-11-methyl-15-oxabicyclo[10.2.1(13,2)]pentadeca-1,6,13-triene
Wiley ID 1604932