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Methyl 2,6-dimethyl-8-methylene-7-(methoxycarbonylmethyl)bicyclo[4.4.0]decane-2-carboxylate
SpectraBase Compound ID EgbIVEzFteF
InChI InChI=1S/C18H28O4/c1-12-7-8-14-17(2,13(12)11-15(19)21-4)9-6-10-18(14,3)16(20)22-5/h13-14H,1,6-11H2,2-5H3/t13-,14?,17+,18-/m0/s1
InChIKey PEEWTCSWPSHLQM-YSCYIJJASA-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 D7hDkPNLUyc
Name Methyl 2,6-dimethyl-8-methylene-7-(methoxycarbonylmethyl)bicyclo[4.4.0]decane-2-carboxylate
Comments Computed using HOSE algorithm
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Exact Mass 308.198759378 u
Formula C18H28O4
InChI InChI=1S/C18H28O4/c1-12-7-8-14-17(2,13(12)11-15(19)21-4)9-6-10-18(14,3)16(20)22-5/h13-14H,1,6-11H2,2-5H3/t13-,14?,17+,18-/m0/s1
InChIKey PEEWTCSWPSHLQM-YSCYIJJASA-N
Molecular Weight 308.418 g/mol
SMILES [C@@]12(C([C@](C(=O)OC)(C)CCC2)CCC([C@@]1(CC(=O)OC)[H])=C)C