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PLAKORSIN-B
SpectraBase Compound ID 7TsPUpKxtu7
InChI InChI=1S/C22H38O3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-20-17-18-21(25-20)19-22(23)24/h17-18H,2-16,19H2,1H3,(H,23,24)
InChIKey MYKNDMTYMCTYAG-UHFFFAOYSA-N
Mol Weight 350.5 g/mol
Molecular Formula C22H38O3
Exact Mass 350.282095 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IFWNSYNgoZF
Name 2-(5-cetyl-2-furyl)acetic acid
Alternate Name(s) Plakorsin B 2-(5-hexadecyl-2-furanyl)acetic acid 2-(5-hexadecyl-2-furyl)acetic acid 2-(5-hexadecylfuran-2-yl)acetic acid 2-(5-hexadecylfuran-2-yl)ethanoic acid
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Formula C22H38O3
InChI InChI=1S/C22H38O3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-20-17-18-21(25-20)19-22(23)24/h17-18H,2-16,19H2,1H3,(H,23,24)
InChIKey MYKNDMTYMCTYAG-UHFFFAOYSA-N
Molecular Weight 350.543 g/mol
SMILES OC(Cc1oc(cc1)CCCCCCCCCCCCCCCC)=O
SPLASH splash10-000i-2901000000-942234b565b058cba79f
Source of Spectrum G4-64-326-7
Wiley ID 1608839