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Lichesterinic acid

View entire compound with spectra: 1 NMR, and 1 MS (GC)

Lichesterinic acid
SpectraBase Compound ID 4r4DZpsimKQ
InChI InChI=1S/C19H32O4/c1-3-4-5-6-7-8-9-10-11-12-13-14-16-17(18(20)21)15(2)19(22)23-16/h16H,3-14H2,1-2H3,(H,20,21)
InChIKey SLQVVNFTCYVCPB-UHFFFAOYSA-N
Mol Weight 324.5 g/mol
Molecular Formula C19H32O4
Exact Mass 324.23006 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 44FcpXrNlw
Name Lichesterinic acid
Alternate Name(s) 4-Methyl-5-oxidanylidene-2-tridecyl-2H-furan-3-carboxylic acid 4-Methyl-5-oxo-2-tridecyl-2H-furan-3-carboxylic acid 5-keto-4-methyl-2-tridecyl-2H-furan-3-carboxylic acid
CAS Registry Number 493-47-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H32O4
InChI InChI=1S/C19H32O4/c1-3-4-5-6-7-8-9-10-11-12-13-14-16-17(18(20)21)15(2)19(22)23-16/h16H,3-14H2,1-2H3,(H,20,21)
InChIKey SLQVVNFTCYVCPB-UHFFFAOYSA-N
Molecular Weight 324.461 g/mol
SMILES OC(C=1C(CCCCCCCCCCCCC)OC(C1C)=O)=O
SPLASH splash10-05e9-0295000000-2639badc87991f9ef718
Source of Spectrum B-32-2569-0
Wiley ID 1323370