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4-formylphenyl 3-methyl-4-nitrobenzoate
SpectraBase Compound ID 8Ikk4Q1XrdV
InChI InChI=1S/C15H11NO5/c1-10-8-12(4-7-14(10)16(19)20)15(18)21-13-5-2-11(9-17)3-6-13/h2-9H,1H3
InChIKey LNXIRGQJTXSWNJ-UHFFFAOYSA-N
Mol Weight 285.25 g/mol
Molecular Formula C15H11NO5
Exact Mass 285.063722 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 88nKORJk6i2
Name 4-formylphenyl 3-methyl-4-nitrobenzoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H11NO5
InChI InChI=1S/C15H11NO5/c1-10-8-12(4-7-14(10)16(19)20)15(18)21-13-5-2-11(9-17)3-6-13/h2-9H,1H3
InChIKey LNXIRGQJTXSWNJ-UHFFFAOYSA-N
Molecular Weight 285.255 g/mol
SMILES c1c(c(ccc1C(Oc1ccc(cc1)C=O)=O)N(=O)=O)C
SPLASH splash10-03di-8900000000-f01f2513fce823730de2
Source of Spectrum IY-2-5126-7
Synonyms 3-Methyl-4-nitrobenzoic acid (4-formylphenyl) ester (4-formylphenyl) 3-methyl-4-nitrobenzoate (4-formylphenyl) 3-methyl-4-nitro-benzoate (4-methanoylphenyl) 3-methyl-4-nitro-benzoate
Wiley ID 1659250