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Fumaric acid, dodecyl 2-norbornyl ester
SpectraBase Compound ID 2vorCNJ5CHj
InChI InChI=1S/C23H38O4/c1-2-3-4-5-6-7-8-9-10-11-16-26-22(24)14-15-23(25)27-21-18-19-12-13-20(21)17-19/h14-15,19-21H,2-13,16-18H2,1H3/b15-14+/t19-,20+,21+/m1/s1
InChIKey KURSALJNHBTWNA-MBTLSUMZSA-N
Mol Weight 378.6 g/mol
Molecular Formula C23H38O4
Exact Mass 378.27701 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Cocatq8Cr8i
Name Fumaric acid, dodecyl 2-norbornyl ester
Comments Computed using HOSE algorithm
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Exact Mass 378.277009700 u
Formula C23H38O4
InChI InChI=1S/C23H38O4/c1-2-3-4-5-6-7-8-9-10-11-16-26-22(24)14-15-23(25)27-21-18-19-12-13-20(21)17-19/h14-15,19-21H,2-13,16-18H2,1H3/b15-14+/t19-,20+,21+/m1/s1
InChIKey KURSALJNHBTWNA-MBTLSUMZSA-N
Molecular Weight 378.553 g/mol
SMILES CCCCCCCCCCCCOC(\C=C\C(O[C@]1(C[C@@]2(CC[C@]1(C2)[H])[H])[H])=O)=O