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1-nitro-3-phenyl-acetone

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1-nitro-3-phenyl-acetone
SpectraBase Compound ID 2irbICtnVh5
InChI InChI=1S/C9H9NO3/c11-9(7-10(12)13)6-8-4-2-1-3-5-8/h1-5H,6-7H2
InChIKey OKYACOSASPGZBU-UHFFFAOYSA-N
Mol Weight 179.17 g/mol
Molecular Formula C9H9NO3
Exact Mass 179.058243 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DHMXKCuhKZc
Name 1-nitro-3-phenyl-acetone
Compound Number 16-H
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C9H9NO3
InChI InChI=1S/C9H9NO3/c11-9(7-10(12)13)6-8-4-2-1-3-5-8/h1-5H,6-7H2
InChIKey OKYACOSASPGZBU-UHFFFAOYSA-N
Literature Reference Author C.F.BERNASCONI,M.ALI,J.C.GUNTER
Literature Reference Citation J.AM.CHEM.SOC.,125,151(2003)
Literature Reference DOI 10.1021/ja0211398
Molecular Weight 179.175 g/mol
Sample ID 40337
Solvent CDCl3