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Sebacic acid, tetrahydrofurfuryl octyl ester
SpectraBase Compound ID 4HkrYDp0a7T
InChI InChI=1S/C23H42O5/c1-2-3-4-5-10-13-18-27-22(24)16-11-8-6-7-9-12-17-23(25)28-20-21-15-14-19-26-21/h21H,2-20H2,1H3
InChIKey WIFJXWUISPPFCB-UHFFFAOYSA-N
Mol Weight 398.6 g/mol
Molecular Formula C23H42O5
Exact Mass 398.303224 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2TWcqbE5D4M
Name Sebacic acid, tetrahydrofurfuryl octyl ester
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 398.303224447 u
Formula C23H42O5
InChI InChI=1S/C23H42O5/c1-2-3-4-5-10-13-18-27-22(24)16-11-8-6-7-9-12-17-23(25)28-20-21-15-14-19-26-21/h21H,2-20H2,1H3
InChIKey WIFJXWUISPPFCB-UHFFFAOYSA-N
Molecular Weight 398.584 g/mol
SMILES C1(CCCO1)COC(CCCCCCCCC(OCCCCCCCC)=O)=O