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Succinic acid, 3-methylbut-2-yl adamant-2-yl ester

View entire compound with spectra: 1 NMR

Succinic acid, 3-methylbut-2-yl adamant-2-yl ester
SpectraBase Compound ID I3NoFfoQGda
InChI InChI=1S/C19H30O4/c1-11(2)12(3)22-17(20)4-5-18(21)23-19-15-7-13-6-14(9-15)10-16(19)8-13/h11-16,19H,4-10H2,1-3H3/t12?,13-,14+,15-,16+,19?
InChIKey PWIRPKYRNGEDNO-PKMPIPOISA-N
Mol Weight 322.45 g/mol
Molecular Formula C19H30O4
Exact Mass 322.214409 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9ku8g4FqiBT
Name Succinic acid, 3-methylbut-2-yl adamant-2-yl ester
Comments Computed using HOSE algorithm
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Exact Mass 322.214409442 u
Formula C19H30O4
InChI InChI=1S/C19H30O4/c1-11(2)12(3)22-17(20)4-5-18(21)23-19-15-7-13-6-14(9-15)10-16(19)8-13/h11-16,19H,4-10H2,1-3H3/t12?,13-,14+,15-,16+,19?
InChIKey PWIRPKYRNGEDNO-PKMPIPOISA-N
Molecular Weight 322.445 g/mol
SMILES C(CC(OC(C(C)C)C)=O)C(OC1[C@]2(C[C@@]3(C[C@@](C[C@]1(C3)[H])(C2)[H])[H])[H])=O