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2-Furanpentadecanoic acid, 3-carboxy-2,5-dihydro-4-methyl-5-oxo-, (R)-
SpectraBase Compound ID GoDm7stOa3V
InChI InChI=1S/C21H34O6/c1-16-19(20(24)25)17(27-21(16)26)14-12-10-8-6-4-2-3-5-7-9-11-13-15-18(22)23/h17H,2-15H2,1H3,(H,22,23)(H,24,25)/t17-/m1/s1
InChIKey RKCUYAAZRBRGTN-QGZVFWFLSA-N
Mol Weight 382.5 g/mol
Molecular Formula C21H34O6
Exact Mass 382.235539 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3c8kNKa3VaI
Name 2-Furanpentadecanoic acid, 3-carboxy-2,5-dihydro-4-methyl-5-oxo-, (R)-
CAS Registry Number 130342-70-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H34O6
InChI InChI=1S/C21H34O6/c1-16-19(20(24)25)17(27-21(16)26)14-12-10-8-6-4-2-3-5-7-9-11-13-15-18(22)23/h17H,2-15H2,1H3,(H,22,23)(H,24,25)/t17-/m1/s1
InChIKey RKCUYAAZRBRGTN-QGZVFWFLSA-N
Molecular Weight 382.497 g/mol
SMILES OC(CCCCCCCCCCCCCC[C@]1(OC(C(=C1C(=O)O)C)=O)[H])=O
SPLASH splash10-0a4i-9000000000-b4815b3c114721572db1
Source of Spectrum B-43-1300-1
Synonyms (+)-Praesorediosic acid (2R)-2-(14-carboxytetradecyl)-4-methyl-5-oxo-2,5-dihydro-3-furancarboxylic acid Praesorediosic acid (2R)-2-(14-carboxytetradecyl)-4-methyl-5-oxo-2H-furan-3-carboxylic acid (2R)-4-methyl-5-oxidanylidene-2-(15-oxidanyl-15-oxidanylidene-pentadecyl)-2H-furan-3-carboxylic acid
Wiley ID 1360573