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6.beta.-1,5-Dimethyl-7-hydroxy-8-(1-hydroxy-1-(hydroxymethyl)ethyl)bicyclo[4.4.0]deca-4-ene
SpectraBase Compound ID AxFTzhjTSaZ
InChI InChI=1S/C15H26O3/c1-10-5-4-7-14(2)8-6-11(13(17)12(10)14)15(3,18)9-16/h5,11-13,16-18H,4,6-9H2,1-3H3/t11?,12-,13?,14?,15?/m1/s1
InChIKey DMCCSWCFZOUCHN-HLTWPCROSA-N
Mol Weight 254.37 g/mol
Molecular Formula C15H26O3
Exact Mass 254.188195 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LMIC4yugeqJ
Name 6.beta.-1,5-Dimethyl-7-hydroxy-8-(1-hydroxy-1-(hydroxymethyl)ethyl)bicyclo[4.4.0]deca-4-ene
Comments Computed using HOSE algorithm
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Exact Mass 254.188194694 u
Formula C15H26O3
InChI InChI=1S/C15H26O3/c1-10-5-4-7-14(2)8-6-11(13(17)12(10)14)15(3,18)9-16/h5,11-13,16-18H,4,6-9H2,1-3H3/t11?,12-,13?,14?,15?/m1/s1
InChIKey DMCCSWCFZOUCHN-HLTWPCROSA-N
Molecular Weight 254.370 g/mol
SMILES C1(C(CCC2([C@@]1(C(=CCC2)C)[H])C)C(O)(CO)C)O