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Preuplotin (All-E)-{2-[6-acetoxy-4-(acetoxymethylene)hex-5-enylidene]-6-methylhept-5-enal}

View entire compound with spectra: 1 MS (GC)

Preuplotin (All-E)-{2-[6-acetoxy-4-(acetoxymethylene)hex-5-enylidene]-6-methylhept-5-enal}
SpectraBase Compound ID 2n4V6hoizTg
InChI InChI=1S/C19H26O5/c1-15(2)7-5-8-18(13-20)9-6-10-19(14-24-17(4)22)11-12-23-16(3)21/h7,9,11-14H,5-6,8,10H2,1-4H3/b12-11+,18-9+,19-14+
InChIKey CWTWXTOOFGPUDG-WLCSQLACSA-N
Mol Weight 334.41 g/mol
Molecular Formula C19H26O5
Exact Mass 334.178024 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2C9IeSfcgK5
Name Preuplotin (All-E)-{2-[6-acetoxy-4-(acetoxymethylene)hex-5-enylidene]-6-methylhept-5-enal}
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H26O5
InChI InChI=1S/C19H26O5/c1-15(2)7-5-8-18(13-20)9-6-10-19(14-24-17(4)22)11-12-23-16(3)21/h7,9,11-14H,5-6,8,10H2,1-4H3/b12-11+,18-9+,19-14+
InChIKey CWTWXTOOFGPUDG-WLCSQLACSA-N
Molecular Weight 334.412 g/mol
SMILES C(O\C=C\C(=C\OC(=O)C)CC\C=C\(C=O)CCC=C(C)C)(=O)C
SPLASH splash10-0006-9320000000-c49c24598a4b6120f56a
Source of Spectrum KC-0-166-4
Synonyms (1E,5E)-2-[(E)-2-(acetyloxy)ethenyl]-6-formyl-10-methyl-1,5,9-undecatrienyl acetate Acetic acid (1E,5E)-2-((E)-2-acetoxy-vinyl)-6-formyl-10-methyl-undeca-1,5,9-trienyl ester Acetic acid[(1E,3E,6E)-3-(acetoxymethylene)-7-formyl-11-methyl-dodeca-1,6,10-trienyl]ester Acetic acid[(1E,3E,6E)-3-(acetyloxymethylidene)-7-formyl-11-methyldodeca-1,6,10-trienyl]ester [(1E,3E,6E)-3-(acetoxymethylene)-7-formyl-11-methyl-dodeca-1,6,10-trienyl]acetate [(1E,3E,6E)-3-(acetyloxymethylidene)-7-formyl-11-methyldodeca-1,6,10-trienyl]acetate [(1E,3E,6E)-3-(acetyloxymethylidene)-7-methanoyl-11-methyl-dodeca-1,6,10-trienyl]ethanoate Acetic acid [(1E,3E,6E)-3-(acetyloxymethylidene)-7-formyl-11-methyldodeca-1,6,10-trienyl] ester [(1E,3E,6E)-3-(acetyloxymethylidene)-7-formyl-11-methyldodeca-1,6,10-trienyl] acetate [(1E,3E,6E)-3-(acetoxymethylene)-7-formyl-11-methyl-dodeca-1,6,10-trienyl] acetate [(1E,3E,6E)-3-(acetyloxymethylidene)-7-methanoyl-11-methyl-dodeca-1,6,10-trienyl] ethanoate
Wiley ID 780427