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1-Nitro-4-(oct-2-ynyl)benzene

View entire compound with spectra: 1 MS (GC)

1-Nitro-4-(oct-2-ynyl)benzene
SpectraBase Compound ID DD1773SSIh7
InChI InChI=1S/C14H17NO2/c1-2-3-4-5-6-7-8-13-9-11-14(12-10-13)15(16)17/h9-12H,2-5,8H2,1H3
InChIKey VMMSTJHZAOGOTG-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 QrB3jYeM0L
Name 1-Nitro-4-(oct-2-ynyl)benzene
Alternate Name(s) 1-Nitro-4-(oct-2-yn-1-yl)benzene 1-Nitro-4-oct-2-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,2-5,8H2,1H3
InChIKey VMMSTJHZAOGOTG-UHFFFAOYSA-N
Literature Reference DOI 10.1021/jo1010284
Molecular Weight 231.295 g/mol
SMILES c1(ccc(CC#CCCCCC)cc1)[N+](=O)[O-]
SPLASH splash10-002b-9700000000-12cedcbe2cf4280e41b7
Source of Spectrum J-75-5263-20
Wiley ID 1746641