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N-[1-(2,5-dioxocyclopentylidene)ethyl]-beta-alanine
SpectraBase Compound ID 9i7PgrAsKVI
InChI InChI=1S/C10H13NO4/c1-6(11-5-4-9(14)15)10-7(12)2-3-8(10)13/h11H,2-5H2,1H3,(H,14,15)
InChIKey SXQKPQQBFBSTAX-UHFFFAOYSA-N
Mol Weight 211.22 g/mol
Molecular Formula C10H13NO4
Exact Mass 211.084458 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID GxfHTavpbS
Name N-[1-(2,5-dioxocyclopentylidene)ethyl]-beta-alanine
Author A.V.Yarkov, IPAC, Russia
Copyright Copyright © 2016-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2021 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C10H13NO4/c1-6(11-5-4-9(14)15)10-7(12)2-3-8(10)13/h11H,2-5H2,1H3,(H,14,15)
InChIKey SXQKPQQBFBSTAX-UHFFFAOYSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI-VK_18310_2146
Owner Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc.
Sample State soluted
Solvent DMSO-d6
Source File Reference VendorID: N04403BM7-044; Labnumber: N04403BM7-044; VK_ID: VK-002147
Temperature 315 °C