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cis-4,5-Dihexyl-4,5-dihydro-3-methlene-2(3H)-furanone
SpectraBase Compound ID AOoz7A1FLF6
InChI InChI=1S/C17H30O2/c1-4-6-8-10-12-15-14(3)17(18)19-16(15)13-11-9-7-5-2/h15-16H,3-13H2,1-2H3/t15-,16-/m0/s1
InChIKey AHTHVJKFHQTKEE-HOTGVXAUSA-N
Mol Weight 266.42 g/mol
Molecular Formula C17H30O2
Exact Mass 266.22458 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DhLiM5H7NRb
Name cis-4,5-Dihexyl-4,5-dihydro-3-methlene-2(3H)-furanone
Comments Computed using HOSE algorithm
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Exact Mass 266.224580204 u
Formula C17H30O2
InChI InChI=1S/C17H30O2/c1-4-6-8-10-12-15-14(3)17(18)19-16(15)13-11-9-7-5-2/h15-16H,3-13H2,1-2H3/t15-,16-/m0/s1
InChIKey AHTHVJKFHQTKEE-HOTGVXAUSA-N
Molecular Weight 266.425 g/mol
SMILES C1(C([C@](CCCCCC)([C@@](O1)(CCCCCC)[H])[H])=C)=O