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2-(4-Methylpiperidin-1-yl)-3-nitrobenzoic acid

View entire compound with spectra: 1 MS (GC)

2-(4-Methylpiperidin-1-yl)-3-nitrobenzoic acid
SpectraBase Compound ID Bkd7JbcMy8
InChI InChI=1S/C13H16N2O4/c1-9-5-7-14(8-6-9)12-10(13(16)17)3-2-4-11(12)15(18)19/h2-4,9H,5-8H2,1H3,(H,16,17)
InChIKey FEHIBIZBCHAJQF-UHFFFAOYSA-N
Mol Weight 264.28 g/mol
Molecular Formula C13H16N2O4
Exact Mass 264.111007 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Lr3fzZiCZi6
Name 2-(4-Methylpiperidin-1-yl)-3-nitrobenzoic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H16N2O4
InChI InChI=1S/C13H16N2O4/c1-9-5-7-14(8-6-9)12-10(13(16)17)3-2-4-11(12)15(18)19/h2-4,9H,5-8H2,1H3,(H,16,17)
InChIKey FEHIBIZBCHAJQF-UHFFFAOYSA-N
Molecular Weight 264.281 g/mol
SMILES OC(c1c(c(N(=O)=O)ccc1)N1CCC(CC1)C)=O
SPLASH splash10-0002-4940000000-823ddecfb174b2c1ced9
Source of Spectrum IY-2-5124-6
Synonyms 2-(4-Methyl-1-piperidinyl)-3-nitrobenzoic acid 2-(4-Methyl-1-piperidyl)-3-nitro-benzoic acid 2-(4-Methylpiperidin-1-yl)-3-nitro-benzoic acid
Wiley ID 1659229