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1-[(Hex-5-yn-1-yloxy)methyl]-4-methoxybenzene
SpectraBase Compound ID 58GJQGAPJjo
InChI InChI=1S/C14H18O2/c1-3-4-5-6-11-16-12-13-7-9-14(15-2)10-8-13/h1,7-10H,4-6,11-12H2,2H3
InChIKey SNNQEJDARURQIT-UHFFFAOYSA-N
Mol Weight 218.3 g/mol
Molecular Formula C14H18O2
Exact Mass 218.13068 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DFrmhINnBtf
Name 1-[(hex-5-yn-1-Yloxy)methyl]-4-methoxybenzene
Comments Computed using HOSE algorithm
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Exact Mass 218.130679818 u
Formula C14H18O2
InChI InChI=1S/C14H18O2/c1-3-4-5-6-11-16-12-13-7-9-14(15-2)10-8-13/h1,7-10H,4-6,11-12H2,2H3
InChIKey SNNQEJDARURQIT-UHFFFAOYSA-N
Molecular Weight 218.296 g/mol
SMILES C(OCC1=CC=C(C=C1)OC)CCCC#C