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para-D1-Benzylcyanide
SpectraBase Compound ID 1Ke8bCRWylo
InChI InChI=1S/C8H7N/c9-7-6-8-4-2-1-3-5-8/h1-5H,6H2/i1D
InChIKey SUSQOBVLVYHIEX-MICDWDOJSA-N
Mol Weight 118.16 g/mol
Molecular Formula C8H6DN
Exact Mass 118.064126 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Gu7fTI1iVTV
Name para-D1-Benzylcyanide
Alternate Name(s) 4-Deutero-.alpha.-cyanotoluene p-Deuteriobenzylcyanide
CAS Registry Number 36696-80-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H6DN
InChI InChI=1S/C8H7N/c9-7-6-8-4-2-1-3-5-8/h1-5H,6H2/i1D
InChIKey SUSQOBVLVYHIEX-MICDWDOJSA-N
Molecular Weight 118.157 g/mol
SMILES C(#N)Cc1ccc(cc1)[D]
SPLASH splash10-014i-9700000000-ab6a29047b503324a817
Source of Spectrum OS-5-271-0
Wiley ID 80767