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1-methoxy-4-[[(3R)-oct-1-yn-3-yl]oxymethyl]benzene
SpectraBase Compound ID 3Dee7UWR7jv
InChI InChI=1S/C16H22O2/c1-4-6-7-8-15(5-2)18-13-14-9-11-16(17-3)12-10-14/h2,9-12,15H,4,6-8,13H2,1,3H3/t15-/m0/s1
InChIKey RFNJYLLDMGPEOX-HNNXBMFYSA-N
Mol Weight 246.35 g/mol
Molecular Formula C16H22O2
Exact Mass 246.16198 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID VJBzxJC2VB
Name 1-methoxy-4-[[(3R)-oct-1-yn-3-yl]oxymethyl]benzene
Alternate Name(s) 1-[[(1R)-1-amylprop-2-ynoxy]methyl]-4-methoxy-benzene 1-[[(1R)-1-ethynylhexoxy]methyl]-4-methoxy-benzene
Comments Less than 3 mono-isotopic peaks
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Formula C16H22O2
InChI InChI=1S/C16H22O2/c1-4-6-7-8-15(5-2)18-13-14-9-11-16(17-3)12-10-14/h2,9-12,15H,4,6-8,13H2,1,3H3/t15-/m0/s1
InChIKey RFNJYLLDMGPEOX-HNNXBMFYSA-N
Molecular Weight 246.350 g/mol
SMILES C(#C)[C@](OCc1ccc(cc1)OC)(CCCCC)[H]
SPLASH splash10-00di-0900000000-626fddcd934315f989de
Source of Spectrum J-62-6652-38
Wiley ID 1249444