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3-Oxabicyclo[14.3.1]eicosa-1(19),16(20),17-trien-14-yne-2-one
SpectraBase Compound ID ECSWctTCYMW
InChI InChI=1S/C19H24O2/c20-19-18-14-11-13-17(16-18)12-9-7-5-3-1-2-4-6-8-10-15-21-19/h11,13-14,16H,1-8,10,15H2
InChIKey GXUKGNLAAPEYJH-UHFFFAOYSA-N
Mol Weight 284.4 g/mol
Molecular Formula C19H24O2
Exact Mass 284.17763 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID D6Bic4pBMlR
Name 3-Oxabicyclo[14.3.1]eicosa-1(19),16(20),17-trien-14-yne-2-one
Comments Computed using HOSE algorithm
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Exact Mass 284.177630011 u
Formula C19H24O2
InChI InChI=1S/C19H24O2/c20-19-18-14-11-13-17(16-18)12-9-7-5-3-1-2-4-6-8-10-15-21-19/h11,13-14,16H,1-8,10,15H2
InChIKey GXUKGNLAAPEYJH-UHFFFAOYSA-N
SMILES C1(C=2C=C(C#CCCCCCCCCCCO1)C=CC2)=O