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(R)-4-(5-methyl-1-phenyl-1H-1,2,3-triazol-4-yl)-4-oxo-2-phenylbutanenitrile
SpectraBase Compound ID 6KhRUdMCTgC
InChI InChI=1S/C19H16N4O/c1-14-19(21-22-23(14)17-10-6-3-7-11-17)18(24)12-16(13-20)15-8-4-2-5-9-15/h2-11,16H,12H2,1H3/t16-/m0/s1
InChIKey VTAPJWBERJWEDM-INIZCTEOSA-N
Mol Weight 316.36 g/mol
Molecular Formula C19H16N4O
Exact Mass 316.132411 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3WNkh0GyvqQ
Name (R)-4-(5-methyl-1-phenyl-1H-1,2,3-triazol-4-yl)-4-oxo-2-phenylbutanenitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H16N4O
InChI InChI=1S/C19H16N4O/c1-14-19(21-22-23(14)17-10-6-3-7-11-17)18(24)12-16(13-20)15-8-4-2-5-9-15/h2-11,16H,12H2,1H3/t16-/m0/s1
InChIKey VTAPJWBERJWEDM-INIZCTEOSA-N
Literature Reference DOI 10.1039/c4gc00386a
Molecular Weight 316.364 g/mol
SMILES [C@@](CC(c1c(C)[n](-c2ccccc2)nn1)=O)(C#N)(c1ccccc1)[H]
SPLASH splash10-004i-7900000000-da840bd980e64b4c19b4
Source of Spectrum GCH-16-3454/SM8-5a
Wiley ID 1755401