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Dimethyl 11(R) / 11(S)-8-oxoeremophil-6(7)-en-12, 15-dioate
SpectraBase Compound ID BUX38ef76Ou
InChI InChI=1S/C17H24O5/c1-10(15(19)21-3)12-9-17(2)11(8-14(12)18)6-5-7-13(17)16(20)22-4/h9-11,13H,5-8H2,1-4H3/t10-,11+,13+,17-/m0/s1
InChIKey JJIMMAMDWDSKBK-ZKAWZIJESA-N
Mol Weight 308.37 g/mol
Molecular Formula C17H24O5
Exact Mass 308.162374 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8UhOPYtJ3hW
Name Dimethyl 11(R) / 11(S)-8-oxoeremophil-6(7)-en-12, 15-dioate
Comments Computed using HOSE algorithm
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Exact Mass 308.162373868 u
Formula C17H24O5
InChI InChI=1S/C17H24O5/c1-10(15(19)21-3)12-9-17(2)11(8-14(12)18)6-5-7-13(17)16(20)22-4/h9-11,13H,5-8H2,1-4H3/t10-,11+,13+,17-/m0/s1
InChIKey JJIMMAMDWDSKBK-ZKAWZIJESA-N
SMILES [C@]12(C=C([C@@](C(=O)OC)(C)[H])C(C[C@]2(CCC[C@@]1(C(=O)OC)[H])[H])=O)C