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Fumaric acid, 6-ethyloct-3-yl hexadecyl ester
SpectraBase Compound ID FqK9lfOgF7o
InChI InChI=1S/C30H56O4/c1-5-9-10-11-12-13-14-15-16-17-18-19-20-21-26-33-29(31)24-25-30(32)34-28(8-4)23-22-27(6-2)7-3/h24-25,27-28H,5-23,26H2,1-4H3/b25-24+
InChIKey MBAPOGUYLSVRKM-OCOZRVBESA-N
Mol Weight 480.8 g/mol
Molecular Formula C30H56O4
Exact Mass 480.41786 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7cHMGGRVqhn
Name Fumaric acid, 6-ethyloct-3-yl hexadecyl ester
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 480.417860279 u
Formula C30H56O4
InChI InChI=1S/C30H56O4/c1-5-9-10-11-12-13-14-15-16-17-18-19-20-21-26-33-29(31)24-25-30(32)34-28(8-4)23-22-27(6-2)7-3/h24-25,27-28H,5-23,26H2,1-4H3/b25-24+
InChIKey MBAPOGUYLSVRKM-OCOZRVBESA-N
Molecular Weight 480.774 g/mol
SMILES C(CCCCOC(\C=C\C(OC(CCC(CC)CC)CC)=O)=O)CCCCCCCCCCC