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Fumaric acid, 2-decyl octadecyl ester

View entire compound with spectra: 1 NMR

Fumaric acid, 2-decyl octadecyl ester
SpectraBase Compound ID I8yl5CtfZMS
InChI InChI=1S/C32H60O4/c1-4-6-8-10-12-13-14-15-16-17-18-19-20-21-23-25-29-35-31(33)27-28-32(34)36-30(3)26-24-22-11-9-7-5-2/h27-28,30H,4-26,29H2,1-3H3/b28-27+
InChIKey QOSRDEQJEKDXHQ-BYYHNAKLSA-N
Mol Weight 508.8 g/mol
Molecular Formula C32H60O4
Exact Mass 508.44916 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6DGt6fHP4Zl
Name Fumaric acid, 2-decyl octadecyl ester
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 508.449160408 u
Formula C32H60O4
InChI InChI=1S/C32H60O4/c1-4-6-8-10-12-13-14-15-16-17-18-19-20-21-23-25-29-35-31(33)27-28-32(34)36-30(3)26-24-22-11-9-7-5-2/h27-28,30H,4-26,29H2,1-3H3/b28-27+
InChIKey QOSRDEQJEKDXHQ-BYYHNAKLSA-N
Molecular Weight 508.828 g/mol
SMILES C(OC(CCCCCCCC)C)(\C=C\C(OCCCCCCCCCCCCCCCCCC)=O)=O