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2-(4-methyl-1-piperidinyl)-5-nitrobenzoic acid

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2-(4-methyl-1-piperidinyl)-5-nitrobenzoic acid
SpectraBase Compound ID 9xbrfZ1fZ3a
InChI InChI=1S/C13H16N2O4/c1-9-4-6-14(7-5-9)12-3-2-10(15(18)19)8-11(12)13(16)17/h2-3,8-9H,4-7H2,1H3,(H,16,17)
InChIKey ISYLQMMLDFSLPI-UHFFFAOYSA-N
Mol Weight 264.28 g/mol
Molecular Formula C13H16N2O4
Exact Mass 264.111007 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID J1OM3ckNpYJ
Name 2-(4-methyl-1-piperidinyl)-5-nitrobenzoic acid
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 264.111006999 u
Formula C13H16N2O4
InChI InChI=1S/C13H16N2O4/c1-9-4-6-14(7-5-9)12-3-2-10(15(18)19)8-11(12)13(16)17/h2-3,8-9H,4-7H2,1H3,(H,16,17)
InChIKey ISYLQMMLDFSLPI-UHFFFAOYSA-N
Molecular Weight 264.281 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2020_1636
Solvent DMSO-d6
Source Vendor ID: NMR/12257435; Lab Info: AI; Lab Number: AI-S001771