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2-Methyl-5-(4-methoxyphenyl)-4-nitrocyclohexanone
SpectraBase Compound ID 7p4J3OQvluM
InChI InChI=1S/C14H17NO4/c1-9-7-13(15(17)18)12(8-14(9)16)10-3-5-11(19-2)6-4-10/h3-6,9,12-13H,7-8H2,1-2H3
InChIKey PJPIHLUCQRNGJH-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 CLhKiUPyxjO
Name 2-Methyl-5-(4-methoxyphenyl)-4-nitrocyclohexanone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H17NO4
InChI InChI=1S/C14H17NO4/c1-9-7-13(15(17)18)12(8-14(9)16)10-3-5-11(19-2)6-4-10/h3-6,9,12-13H,7-8H2,1-2H3
InChIKey PJPIHLUCQRNGJH-UHFFFAOYSA-N
Molecular Weight 263.293 g/mol
SMILES C1(C(CC(C(C1)c1ccc(cc1)OC)N(=O)=O)C)=O
SPLASH splash10-014r-0390000000-e69c324e9160ce47422b
Source of Spectrum SO-0-1243-5
Synonyms 5-(4-Methoxyphenyl)-2-methyl-4-nitrocyclohexanone
Wiley ID 1543808