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2-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)butanoic acid
SpectraBase Compound ID 20Sa3CoOfhe
InChI InChI=1S/C12H11NO4/c1-2-9(12(16)17)13-10(14)7-5-3-4-6-8(7)11(13)15/h3-6,9H,2H2,1H3,(H,16,17)
InChIKey URWCIQUEFSJOJG-UHFFFAOYSA-N
Mol Weight 233.22 g/mol
Molecular Formula C12H11NO4
Exact Mass 233.068808 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID x3NI9ed72s
Name 2-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)butanoic 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 233.068807834 u
Formula C12H11NO4
InChI InChI=1S/C12H11NO4/c1-2-9(12(16)17)13-10(14)7-5-3-4-6-8(7)11(13)15/h3-6,9H,2H2,1H3,(H,16,17)
InChIKey URWCIQUEFSJOJG-UHFFFAOYSA-N
Molecular Weight 233.223 g/mol
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2020_5769
Solvent DMSO-d6
Source Vendor ID: NMR/12669010
Temperature 23.85 °C