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1-Nitro-4-(oct-1-ynyl)benzene
SpectraBase Compound ID KGb0rn8dJl9
InChI InChI=1S/C14H17NO2/c1-2-3-4-5-6-7-8-13-9-11-14(12-10-13)15(16)17/h9-12H,2-6H2,1H3
InChIKey CGOAGKYOZBGGJG-UHFFFAOYSA-N
Mol Weight 231.29 g/mol
Molecular Formula C14H17NO2
Exact Mass 231.125929 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5qsVT4LWo9s
Name 1-Nitro-4-(oct-1-ynyl)benzene
Alternate Name(s) 1-Nitro-4-(oct-1-yn-1-yl)benzene 1-Nitro-4-oct-1-ynylbenzene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H17NO2
InChI InChI=1S/C14H17NO2/c1-2-3-4-5-6-7-8-13-9-11-14(12-10-13)15(16)17/h9-12H,2-6H2,1H3
InChIKey CGOAGKYOZBGGJG-UHFFFAOYSA-N
Literature Reference DOI 10.1002/adsc.200900348
Molecular Weight 231.295 g/mol
SMILES c1(ccc(cc1)C#CCCCCCC)[N+](=O)[O-]
SPLASH splash10-0fvu-0930000000-3c29b0236447521d313e
Source of Spectrum ASC-351-2411/SM6-2e
Wiley ID 1763400