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4,4'-oxalyldibenzonitrile
SpectraBase Compound ID KNeoNAaz7kO
InChI InChI=1S/C16H8N2O2/c17-9-11-1-5-13(6-2-11)15(19)16(20)14-7-3-12(10-18)4-8-14/h1-8H
InChIKey MXWFKRLTIMWOFB-UHFFFAOYSA-N
Mol Weight 260.25 g/mol
Molecular Formula C16H8N2O2
Exact Mass 260.058578 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AHWFQRcDxqE
Name 4,4'-oxalyldibenzonitrile
Appearance Yellow solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 260.058577504 u
Formula C16H8N2O2
InChI InChI=1S/C16H8N2O2/c17-9-11-1-5-13(6-2-11)15(19)16(20)14-7-3-12(10-18)4-8-14/h1-8H
InChIKey MXWFKRLTIMWOFB-UHFFFAOYSA-N
Instrument Name Shimadzu GCMS-QP2010S
Ionization Type EI
Literature Reference DOI 10.1002/ejoc.201900783
Molecular Weight 260.252 g/mol
Quality 85
SMILES C(C(=O)C1=CC=C(C#N)C=C1)(=O)C1=CC=C(C#N)C=C1
SPLASH splash10-001i-1900000000-1562680fcefc8b1cfeb9
Source of Spectrum K1-2019-SM12-3p (DOI: 10.1002/ejoc.201900783)
Wiley ID 1892106