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2-(3-Hydroxy-2-nitrocyclohexyl)-1-phenylethanone

View entire compound with spectra: 2 MS (GC)

2-(3-Hydroxy-2-nitrocyclohexyl)-1-phenylethanone
SpectraBase Compound ID EbHXmPFSncC
InChI InChI=1S/C14H17NO4/c16-12-8-4-7-11(14(12)15(18)19)9-13(17)10-5-2-1-3-6-10/h1-3,5-6,11-12,14,16H,4,7-9H2
InChIKey PMPHKGHMAJBNCE-UHFFFAOYSA-N
Mol Weight 263.29 g/mol
Molecular Formula C14H17NO4
Exact Mass 263.115758 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Ck6qboRSwO2
Name 2-(3-Hydroxy-2-nitrocyclohexyl)-1-phenylethanone
Alternate Name(s) 2-(2-nitro-3-oxidanyl-cyclohexyl)-1-phenyl-ethanone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H17NO4
InChI InChI=1S/C14H17NO4/c16-12-8-4-7-11(14(12)15(18)19)9-13(17)10-5-2-1-3-6-10/h1-3,5-6,11-12,14,16H,4,7-9H2
InChIKey PMPHKGHMAJBNCE-UHFFFAOYSA-N
Molecular Weight 263.293 g/mol
SMILES OC1CCCC(C1N(=O)=O)CC(=O)c1ccccc1
SPLASH splash10-0a4i-3900000000-4a10bd5c6ab23ae19118
Wiley ID 1486571