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(2S-cis)-(-)-5-Benzyl-3,6-dioxo-2-piperazineacetic acid

View entire compound with spectra: 2 NMR, and 2 FTIR

(2S-cis)-(-)-5-Benzyl-3,6-dioxo-2-piperazineacetic acid
SpectraBase Compound ID I6pXOriFAAX
InChI InChI=1S/C13H14N2O4/c16-11(17)7-10-13(19)14-9(12(18)15-10)6-8-4-2-1-3-5-8/h1-5,9-10H,6-7H2,(H,14,19)(H,15,18)(H,16,17)/t9-,10-/m0/s1
InChIKey VNHJXYUDIBQDDX-UWVGGRQHSA-N
Mol Weight 262.26 g/mol
Molecular Formula C13H14N2O4
Exact Mass 262.095357 g/mol

13C Nuclear Magnetic Resonance (NMR) Spectrum

13C Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID J6lq8EeVpZ3
Name (2S-cis)-(-)-5-Benzyl-3,6-dioxo-2-piperazineacetic acid
Source of Sample Sigma-Aldrich Co. LLC.
Catalog Number 421650
CAS Registry Number 5262-10-2
Copyright Copyright © 2021-2024 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2021 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H14N2O4
InChI InChI=1S/C13H14N2O4/c16-11(17)7-10-13(19)14-9(12(18)15-10)6-8-4-2-1-3-5-8/h1-5,9-10H,6-7H2,(H,14,19)(H,15,18)(H,16,17)/t9-,10-/m0/s1
InChIKey VNHJXYUDIBQDDX-UWVGGRQHSA-N
Observed nucleus 13C
Purity 97%
Solvent DMSO-d6
Source of Spectrum Sigma-Aldrich Co. LLC.
Synonyms CCRIS 5457 (2S-cis)-5-Benzyl-3,6-dioxopiperazine-2-acetic acid
Wiley ID SIAL_13CNMR_009343