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.alpha.-D2-benzylcyanide
SpectraBase Compound ID APFkVlK7Grt
InChI InChI=1S/C8H7N/c9-7-6-8-4-2-1-3-5-8/h1-5H,6H2/i6D2
InChIKey SUSQOBVLVYHIEX-NCYHJHSESA-N
Mol Weight 119.16 g/mol
Molecular Formula C8H5D2N
Exact Mass 119.070403 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7fUv0w5kmDt
Name .alpha.-D2-benzylcyanide
Alternate Name(s) .alpha.,.alpha.-Dideutero.alpha.-cyanotoluene Benzyl cyanide-2,2-D2 Phenylacetonitrile-2,2-D2 2,2-Dideuterio-2-phenylacetonitrile 2,2-Dideuterio-2-phenyl-ethanenitrile
CAS Registry Number 935-66-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H5D2N
InChI InChI=1S/C8H7N/c9-7-6-8-4-2-1-3-5-8/h1-5H,6H2/i6D2
InChIKey SUSQOBVLVYHIEX-NCYHJHSESA-N
Molecular Weight 119.163 g/mol
SMILES C(#N)C(c1ccccc1)([D])[D]
SPLASH splash10-014l-9800000000-b515ecf59a5d1e4c8b62
Source of Spectrum T-68-1040-0
Wiley ID 3705