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Fumaric acid, heptyl 2-norbornyl ester

View entire compound with spectra: 1 NMR

Fumaric acid, heptyl 2-norbornyl ester
SpectraBase Compound ID FD9dXYLr5XJ
InChI InChI=1S/C18H28O4/c1-2-3-4-5-6-11-21-17(19)9-10-18(20)22-16-13-14-7-8-15(16)12-14/h9-10,14-16H,2-8,11-13H2,1H3/b10-9+/t14-,15+,16+/m1/s1
InChIKey HVHJZRGXCDTIPP-VEFWAYJRSA-N
Mol Weight 308.42 g/mol
Molecular Formula C18H28O4
Exact Mass 308.198759 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KNeIP9TIByx
Name Fumaric acid, heptyl 2-norbornyl ester
Comments Computed using HOSE algorithm
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Exact Mass 308.198759378 u
Formula C18H28O4
InChI InChI=1S/C18H28O4/c1-2-3-4-5-6-11-21-17(19)9-10-18(20)22-16-13-14-7-8-15(16)12-14/h9-10,14-16H,2-8,11-13H2,1H3/b10-9+/t14-,15+,16+/m1/s1
InChIKey HVHJZRGXCDTIPP-VEFWAYJRSA-N
Molecular Weight 308.418 g/mol
SMILES C(CCCCCOC(\C=C\C(O[C@]1(C[C@@]2(CC[C@]1(C2)[H])[H])[H])=O)=O)C