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2-(3-Methoxybenzylidene)-6-(3-nitrobenzylidene)cyclohexanone
SpectraBase Compound ID 3pXouclaove
InChI InChI=1S/C21H19NO4/c1-26-20-10-3-6-16(14-20)12-18-8-4-7-17(21(18)23)11-15-5-2-9-19(13-15)22(24)25/h2-3,5-6,9-14H,4,7-8H2,1H3/b17-11+,18-12+
InChIKey PTWPZUJQBHXEGB-JYFOCSDGSA-N
Mol Weight 349.39 g/mol
Molecular Formula C21H19NO4
Exact Mass 349.131408 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AzxvxZujNi4
Name 2-(3-Methoxybenzylidene)-6-(3-nitrobenzylidene)cyclohexanone
Alternate Name(s) (2E,6E)-2-[(3-methoxyphenyl)methylidene]-6-[(3-nitrophenyl)methylidene]-1-cyclohexanone (2E,6E)-2-[(3-methoxyphenyl)methylene]-6-[(3-nitrophenyl)methylene]cyclohexanone (2E,6E)-2-[(3-methoxyphenyl)methylidene]-6-[(3-nitrophenyl)methylidene]cyclohexan-1-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H19NO4
InChI InChI=1S/C21H19NO4/c1-26-20-10-3-6-16(14-20)12-18-8-4-7-17(21(18)23)11-15-5-2-9-19(13-15)22(24)25/h2-3,5-6,9-14H,4,7-8H2,1H3/b17-11+,18-12+
InChIKey PTWPZUJQBHXEGB-JYFOCSDGSA-N
Molecular Weight 349.386 g/mol
SMILES C1(\C(CCC\C1=C\c1cc(ccc1)N(=O)=O)=C\c1cc(ccc1)OC)=O
SPLASH splash10-00lr-0009000000-0e29a2a97eafb8ebb245
Source of Spectrum F2-50-120-5f
Wiley ID 1716616