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13,14,14,14-tetradeuterio-13-(trideuteriomethyl)tetradec-3-enenitrile
SpectraBase Compound ID GXLk6ZmDp6q
InChI InChI=1S/C15H27N/c1-15(2)13-11-9-7-5-3-4-6-8-10-12-14-16/h8,10,15H,3-7,9,11-13H2,1-2H3/i1D3,2D3,15D
InChIKey UJSKGYHYIDUPNM-MSDSXZSWSA-N
Mol Weight 228.43 g/mol
Molecular Formula C15H20D7N
Exact Mass 228.258287 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EfyAXw3fejo
Name 13,14,14,14-tetradeuterio-13-(trideuteriomethyl)tetradec-3-enenitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 228.258287095 u
Formula C15H20D7N
InChI InChI=1S/C15H27N/c1-15(2)13-11-9-7-5-3-4-6-8-10-12-14-16/h8,10,15H,3-7,9,11-13H2,1-2H3/i1D3,2D3,15D
InChIKey UJSKGYHYIDUPNM-MSDSXZSWSA-N
Instrument Name HP 5973-6890
Ionization Type EI
Literature Reference DOI 10.1002/anie.201611940
Molecular Weight 228.431 g/mol
Quality 922
SMILES C(CCCCCCCC=CCC#N)C(C([D])([D])[D])(C([D])([D])[D])[D]
SPLASH splash10-007p-9400000000-bd51258b99e011437ab6
Source of Spectrum ACI-56-SM18-Figure S22-2 (DOI: 10.1002/anie.201611940)
Wiley ID 1895678