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.beta.-Alanine, N-(2-carboxyethyl)-N-nitro-
SpectraBase Compound ID EYqleBqKWI4
InChI InChI=1S/C6H10N2O6/c9-5(10)1-3-7(8(13)14)4-2-6(11)12/h1-4H2,(H,9,10)(H,11,12)
InChIKey MXPYFZODOSRODU-UHFFFAOYSA-N
Mol Weight 206.15 g/mol
Molecular Formula C6H10N2O6
Exact Mass 206.053886 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Co0IKZ8jiVu
Name .beta.-Alanine, N-(2-carboxyethyl)-N-nitro-
CAS Registry Number 99-69-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C6H10N2O6
InChI InChI=1S/C6H10N2O6/c9-5(10)1-3-7(8(13)14)4-2-6(11)12/h1-4H2,(H,9,10)(H,11,12)
InChIKey MXPYFZODOSRODU-UHFFFAOYSA-N
Molecular Weight 206.154 g/mol
SMILES OC(CCN(CCC(O)=O)N(=O)=O)=O
SPLASH splash10-052f-9100000000-beae7db087930d9725e5
Synonyms 2,2'-Dicarboxy-N-nitrodiethylamine acid 3,3'-Nitroiminodipropionic acid 3-[2-carboxyethyl(nitro)amino]propanoic acid 3-[2-carboxyethyl(nitro)amino]propionic acid N-(2-Carboxyethyl)-N-nitro-.beta.-alanine BRN 1795030 EINECS 202-779-4 NSC 206121
Wiley ID 1456373