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4,11-Dimethyl-8-(propan-2-yl)-5,12-dioxatricyclo[9.1.0.04,6]dodecan-7-ol, ac
SpectraBase Compound ID IbTcPt6XjsC
InChI InChI=1S/C17H28O4/c1-10(2)12-6-8-16(4)13(20-16)7-9-17(5)15(21-17)14(12)19-11(3)18/h10,12-15H,6-9H2,1-5H3
InChIKey BRHGPQLYUMYCRL-UHFFFAOYSA-N
Mol Weight 296.41 g/mol
Molecular Formula C17H28O4
Exact Mass 296.198759 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HCLichKO4Wt
Name 4,11-Dimethyl-8-(propan-2-yl)-5,12-dioxatricyclo[9.1.0.04,6]dodecan-7-ol, ac
Comments Computed using HOSE algorithm
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Exact Mass 296.198759378 u
Formula C17H28O4
InChI InChI=1S/C17H28O4/c1-10(2)12-6-8-16(4)13(20-16)7-9-17(5)15(21-17)14(12)19-11(3)18/h10,12-15H,6-9H2,1-5H3
InChIKey BRHGPQLYUMYCRL-UHFFFAOYSA-N
Molecular Weight 296.407 g/mol
SMILES C12CCC3(OC3C(C(CCC1(O2)C)C(C)C)OC(=O)C)C