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Diacetylpycnolide
SpectraBase Compound ID 660DFVRN50S
InChI InChI=1S/C24H32O8/c1-8-16(4)23(27)31-20(11-14(2)9-10-29-18(6)25)22-17(5)24(28)32-21(22)12-15(3)13-30-19(7)26/h8-9,12,20-22H,5,10-11,13H2,1-4,6-7H3/b14-9-,15-12+,16-8+
InChIKey WIPYEQSQIIGPCX-YAPMBXKYSA-N
Mol Weight 448.5 g/mol
Molecular Formula C24H32O8
Exact Mass 448.209718 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6jxgqAGrVNM
Name Diacetylpycnolide
Alternate Name(s) (3Z)-5-(acetyloxy)-1-{2-[(1E)-3-(acetyloxy)-2-methyl-1-propenyl]-4-methylene-5-oxotetrahydro-3-furanyl}-3-methyl-3-pentenyl (2E)-2-methyl-2-butenoate
CAS Registry Number 55186-22-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H32O8
InChI InChI=1S/C24H32O8/c1-8-16(4)23(27)31-20(11-14(2)9-10-29-18(6)25)22-17(5)24(28)32-21(22)12-15(3)13-30-19(7)26/h8-9,12,20-22H,5,10-11,13H2,1-4,6-7H3/b14-9-,15-12+,16-8+
InChIKey WIPYEQSQIIGPCX-YAPMBXKYSA-N
Molecular Weight 448.512 g/mol
SMILES C1(C(C(C(OC(\C(=C\C)C)=O)C\C(=C/COC(=O)C)C)C(O1)\C=C\(COC(=O)C)C)=C)=O
SPLASH splash10-001j-9510000000-e0b75f708afeaf382812
Source of Spectrum J-41-1252-0
Wiley ID 1387148