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1-(4-Nitrophenyl)octan-3-one

View entire compound with spectra: 1 MS (GC)

1-(4-Nitrophenyl)octan-3-one
SpectraBase Compound ID BEROaoOV0j3
InChI InChI=1S/C14H19NO3/c1-2-3-4-5-14(16)11-8-12-6-9-13(10-7-12)15(17)18/h6-7,9-10H,2-5,8,11H2,1H3
InChIKey QMARQKRLPAHCCD-UHFFFAOYSA-N
Mol Weight 249.31 g/mol
Molecular Formula C14H19NO3
Exact Mass 249.136493 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GeyLCnjFeYh
Name 1-(4-Nitrophenyl)octan-3-one
Alternate Name(s) 1-(4-nitrophenyl)-3-octanone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H19NO3
InChI InChI=1S/C14H19NO3/c1-2-3-4-5-14(16)11-8-12-6-9-13(10-7-12)15(17)18/h6-7,9-10H,2-5,8,11H2,1H3
InChIKey QMARQKRLPAHCCD-UHFFFAOYSA-N
Molecular Weight 249.310 g/mol
SMILES C(CC(CCCCC)=O)c1ccc(cc1)N(=O)=O
SPLASH splash10-0002-9000000000-a91950fd3a96f5fa2a42
Source of Spectrum F4-0-3449-3
Wiley ID 1620857