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4-Nitro-1-[2-(3-phenylprop-1-ynyl)phenyl]-1-pentanone
SpectraBase Compound ID HMjgtX79FUU
InChI InChI=1S/C20H19NO3/c1-16(21(23)24)14-15-20(22)19-13-6-5-11-18(19)12-7-10-17-8-3-2-4-9-17/h2-6,8-9,11,13,16H,10,14-15H2,1H3
InChIKey INSVHRPYXHLSPI-UHFFFAOYSA-N
Mol Weight 321.38 g/mol
Molecular Formula C20H19NO3
Exact Mass 321.136493 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GEY9y68KZ1y
Name 4-Nitro-1-[2-(3-phenylprop-1-ynyl)phenyl]-1-pentanone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H19NO3
InChI InChI=1S/C20H19NO3/c1-16(21(23)24)14-15-20(22)19-13-6-5-11-18(19)12-7-10-17-8-3-2-4-9-17/h2-6,8-9,11,13,16H,10,14-15H2,1H3
InChIKey INSVHRPYXHLSPI-UHFFFAOYSA-N
Molecular Weight 321.376 g/mol
SMILES C(N(=O)=O)(CCC(c1c(C#CCc2ccccc2)cccc1)=O)C
SPLASH splash10-0kul-0490000000-a4d2ff22d899eb1d61a5
Source of Spectrum H-2005-2728-31
Synonyms 4-Nitro-1-[2-(3-phenylprop-1-ynyl)phenyl]pentan-1-one
Wiley ID 1563036