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2-fluoro-2-(4-nitrophenyl)cyclohexanone
SpectraBase Compound ID 9yZp09SN9Aa
InChI InChI=1S/C12H12FNO3/c13-12(8-2-1-3-11(12)15)9-4-6-10(7-5-9)14(16)17/h4-7H,1-3,8H2
InChIKey DNEAHNQWKLIQCV-UHFFFAOYSA-N
Mol Weight 237.23 g/mol
Molecular Formula C12H12FNO3
Exact Mass 237.080121 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5PjrjpZ9hKK
Name 2-fluoro-2-(4-nitrophenyl)cyclohexanone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H12FNO3
InChI InChI=1S/C12H12FNO3/c13-12(8-2-1-3-11(12)15)9-4-6-10(7-5-9)14(16)17/h4-7H,1-3,8H2
InChIKey DNEAHNQWKLIQCV-UHFFFAOYSA-N
Ionization Type EI
Molecular Weight 237.230 g/mol
Reported Formula C12H12FNO3
SMILES C1(CCCCC1=O)(c1ccc(cc1)[N+]([O-])=O)F
SPLASH splash10-014l-0900000000-fad78175f5219e2b3590
Source of Spectrum CN109232149A
Wiley ID 1872548