Benzene, [(2-nitrocyclohexyl)ethynyl]-

SpectraBase Compound ID	464tzHWmnT5
InChI	InChI=1S/C14H15NO2/c16-15(17)14-9-5-4-8-13(14)11-10-12-6-2-1-3-7-12/h1-3,6-7,13-14H,4-5,8-9H2
InChIKey	KLCBFVJVNMRQJW-UHFFFAOYSA-N Google Search
Mol Weight	229.28 g/mol
Molecular Formula	C14H15NO2
Exact Mass	229.110279 g/mol

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SpectraBase Spectrum ID	GIJYON5gJdt
Name	Benzene, [(2-nitrocyclohexyl)ethynyl]-
CAS Registry Number	118921-56-5
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C14H15NO2
InChI	InChI=1S/C14H15NO2/c16-15(17)14-9-5-4-8-13(14)11-10-12-6-2-1-3-7-12/h1-3,6-7,13-14H,4-5,8-9H2
InChIKey	KLCBFVJVNMRQJW-UHFFFAOYSA-N
Molecular Weight	229.279 g/mol
SMILES	C1(N(=O)=O)C(C#Cc2ccccc2)CCCC1
SPLASH	splash10-0699-4900000000-ff5420c45a0788dc418b
Source of Spectrum	J-54-2395-20
Synonyms	[(2-Nitrocyclohexyl)ethynyl]benzene
Wiley ID	1230845