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3-((E)-1-hydroxy-3-phenylallyl)-4-((E)-pyrrolidin-1-yldiazenyl)benzonitrile
SpectraBase Compound ID KeMgtWJ24ym
InChI InChI=1S/C20H20N4O/c21-15-17-8-10-19(22-23-24-12-4-5-13-24)18(14-17)20(25)11-9-16-6-2-1-3-7-16/h1-3,6-11,14,20,25H,4-5,12-13H2/b11-9+,23-22+
InChIKey LLNCDMXCBDZWEV-VABOGCDNSA-N
Mol Weight 332.41 g/mol
Molecular Formula C20H20N4O
Exact Mass 332.163711 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1JNHal9sIyY
Name 3-((E)-1-hydroxy-3-phenylallyl)-4-((E)-pyrrolidin-1-yldiazenyl)benzonitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H20N4O
InChI InChI=1S/C20H20N4O/c21-15-17-8-10-19(22-23-24-12-4-5-13-24)18(14-17)20(25)11-9-16-6-2-1-3-7-16/h1-3,6-11,14,20,25H,4-5,12-13H2/b11-9+,23-22+
InChIKey LLNCDMXCBDZWEV-VABOGCDNSA-N
Literature Reference DOI 10.1002/anie.201306632
Molecular Weight 332.407 g/mol
SMILES OC(c1cc(ccc1\N=N\N1CCCC1)C#N)\C=C\c1ccccc1
SPLASH splash10-007f-9723000000-3062d0ca0b14e24887ab
Source of Spectrum ACI-52-SM-3n
Wiley ID 1781956