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2-[(1R,2R)-2-hex-1-ynylcyclopropyl]-2-methyl-propanenitrile
SpectraBase Compound ID ITJE50WfIh6
InChI InChI=1S/C13H19N/c1-4-5-6-7-8-11-9-12(11)13(2,3)10-14/h11-12H,4-6,9H2,1-3H3/t11-,12-/m1/s1
InChIKey LOFKOYSCRJWWPA-VXGBXAGGSA-N
Mol Weight 189.3 g/mol
Molecular Formula C13H19N
Exact Mass 189.15175 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1y1M6AfdH4R
Name 2-[(1R,2R)-2-hex-1-ynylcyclopropyl]-2-methyl-propanenitrile
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Exact Mass 189.151749616 u
Formula C13H19N
InChI InChI=1S/C13H19N/c1-4-5-6-7-8-11-9-12(11)13(2,3)10-14/h11-12H,4-6,9H2,1-3H3/t11-,12-/m1/s1
InChIKey LOFKOYSCRJWWPA-VXGBXAGGSA-N
Ionization Type EI
Molecular Weight 189.302 g/mol
Quality 198
Reported Formula C13H19N
SMILES C([C@]1([C@@](C1)(C#CCCCC)[H])[H])(C)(C)C#N
SPLASH splash10-05dl-9400000000-438c5f1ae5d3aae21944
Source of Spectrum CN111362832B
Wiley ID 1894774