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Glutaric acid, 3-methylbut-2-en-1-yl octadecyl ester

View entire compound with spectra: 1 NMR

Glutaric acid, 3-methylbut-2-en-1-yl octadecyl ester
SpectraBase Compound ID Eo8zDOzrU6k
InChI InChI=1S/C28H52O4/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-24-31-27(29)21-20-22-28(30)32-25-23-26(2)3/h23H,4-22,24-25H2,1-3H3
InChIKey BOJHZNOYNZDTSV-UHFFFAOYSA-N
Mol Weight 452.7 g/mol
Molecular Formula C28H52O4
Exact Mass 452.38656 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID AVkEdgC8Osd
Name Glutaric acid, 3-methylbut-2-en-1-yl octadecyl ester
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 452.386560150 u
Formula C28H52O4
InChI InChI=1S/C28H52O4/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-24-31-27(29)21-20-22-28(30)32-25-23-26(2)3/h23H,4-22,24-25H2,1-3H3
InChIKey BOJHZNOYNZDTSV-UHFFFAOYSA-N
Molecular Weight 452.720 g/mol
SMILES C(CCC(OCC=C(C)C)=O)C(OCCCCCCCCCCCCCCCCCC)=O