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2-CYANO-2-ADAMANTANEACETONITRILE

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2-CYANO-2-ADAMANTANEACETONITRILE
SpectraBase Compound ID AgfIpCMqjdF
InChI InChI=1S/C13H16N2/c14-2-1-13(8-15)11-4-9-3-10(6-11)7-12(13)5-9/h9-12H,1,3-7H2/t9-,10+,11-,12+,13?
InChIKey FSEQXQLEGFWHES-HTYKTIJTSA-N
Mol Weight 200.28 g/mol
Molecular Formula C13H16N2
Exact Mass 200.131349 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6EXYSeqdLAG
Name 2-CYANO-2-ADAMANTANEACETONITRILE
Source of Sample G. B. Paerels, N. V. Philips-Duphar, Weesp, Holland
Comments Tentative assignment
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H16N2
InChI InChI=1S/C13H16N2/c14-2-1-13(8-15)11-4-9-3-10(6-11)7-12(13)5-9/h9-12H,1,3-7H2/t9-,10+,11-,12+,13?
InChIKey FSEQXQLEGFWHES-HTYKTIJTSA-N
Melting Point 126-127C
Molecular Weight 200.29
Solvent Chloroform-d; Reference=TMS Spectrometer= Varian CFT-20
Synonyms 2-ADAMANTANEACETONITRILE, 2-CYANO-,