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23-Methyl-tetracos-5,9-dienoic acid, pyrrolidide

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23-Methyl-tetracos-5,9-dienoic acid, pyrrolidide
SpectraBase Compound ID KQYOIZSv2c4
InChI InChI=1S/C29H53NO/c1-28(2)24-20-18-16-14-12-10-8-6-4-3-5-7-9-11-13-15-17-19-21-25-29(31)30-26-22-23-27-30/h7,9,15,17,28H,3-6,8,10-14,16,18-27H2,1-2H3/b9-7-,17-15-
InChIKey OIUCBSUCSMVXNO-UNNWTIKVSA-N
Mol Weight 431.7 g/mol
Molecular Formula C29H53NO
Exact Mass 431.412715 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID GOZEkThh1YQ
Name 23-Methyl-tetracos-5,9-dienoic acid, pyrrolidide
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 431.412715330 u
Formula C29H53NO
InChI InChI=1S/C29H53NO/c1-28(2)24-20-18-16-14-12-10-8-6-4-3-5-7-9-11-13-15-17-19-21-25-29(31)30-26-22-23-27-30/h7,9,15,17,28H,3-6,8,10-14,16,18-27H2,1-2H3/b9-7-,17-15-
InChIKey OIUCBSUCSMVXNO-UNNWTIKVSA-N
Molecular Weight 431.749 g/mol
SMILES C(N1CCCC1)(CCC\C=C/CC\C=C/CCCCCCCCCCCCC(C)C)=O