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alpha-[(2-Ethoxy-2-oxoethoxy)imino]-3-pyrazoleacetic acid,mixture of syn and anti
SpectraBase Compound ID 9dikDSDhVDs
InChI InChI=1S/C9H11N3O5/c1-2-16-7(13)5-17-12-8(9(14)15)6-3-4-10-11-6/h3-4H,2,5H2,1H3,(H,10,11)(H,14,15)/b12-8-
InChIKey HWVWHAMUHWPKPD-WQLSENKSSA-N
Mol Weight 241.2 g/mol
Molecular Formula C9H11N3O5
Exact Mass 241.06987 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DAuQ93a04hF
Name alpha-((2-ethoxy-2-oxoethoxy)imino)-3-pyrazoleacetic acid
CAS Registry Number 84080-54-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H11N3O5
InChI InChI=1S/C9H11N3O5/c1-2-16-7(13)5-17-12-8(9(14)15)6-3-4-10-11-6/h3-4H,2,5H2,1H3,(H,10,11)(H,14,15)/b12-8-
InChIKey HWVWHAMUHWPKPD-WQLSENKSSA-N
Molecular Weight 241.203 g/mol
SMILES [nH]1nccc1\C(C(=O)O)=N/OCC(=O)OCC
SPLASH splash10-0006-9000000000-4790b2efc2293299732e
Synonyms (2Z)-[(2-ethoxy-2-oxoethoxy)imino](1H-pyrazol-5-yl)ethanoic acid .alpha.-((2-ethoxy-2-oxoethoxy)imino)-3-pyrazoleacetic acid [(2-ethoxy-2-oxoethoxy)imino](1H-pyrazol-5-yl)ethanoic acid
Wiley ID 1450973