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PLAKORTIC-ACID
SpectraBase Compound ID 3G8y0zzVxfa
InChI InChI=1S/C22H38O4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-19(23)17-18-20-21(26-20)22(24)25/h17-18,20-21H,2-16H2,1H3,(H,24,25)/b18-17+
InChIKey LOPUOQXRVYARTM-ISLYRVAYSA-N
Mol Weight 366.5 g/mol
Molecular Formula C22H38O4
Exact Mass 366.27701 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LD40EpjlmRw
Name 3-[(E)-3-ketononadec-1-enyl]oxirane-2-carboxylic acid
Alternate Name(s) 3-[(E)-3-oxidanylidenenonadec-1-enyl]oxirane-2-carboxylic acid 3-[(E)-3-oxononadec-1-enyl]-2-oxiranecarboxylic acid 3-[(E)-3-oxononadec-1-enyl]oxirane-2-carboxylic acid
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Formula C22H38O4
InChI InChI=1S/C22H38O4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-19(23)17-18-20-21(26-20)22(24)25/h17-18,20-21H,2-16H2,1H3,(H,24,25)/b18-17+
InChIKey LOPUOQXRVYARTM-ISLYRVAYSA-N
Molecular Weight 366.542 g/mol
SMILES OC(C1C(\C=C\C(CCCCCCCCCCCCCCCC)=O)O1)=O
SPLASH splash10-0a4i-9300000000-e07aec514afbc335e764
Source of Spectrum G4-64-326-9
Wiley ID 1608837