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2-[(5-methylol-2-furoyl)amino]acetic acid
SpectraBase Compound ID 5gzyXkZjN9I
InChI InChI=1S/C8H9NO5/c10-4-5-1-2-6(14-5)8(13)9-3-7(11)12/h1-2,10H,3-4H2,(H,9,13)(H,11,12)
InChIKey HBULKUDERNWOBN-UHFFFAOYSA-N
Mol Weight 199.16 g/mol
Molecular Formula C8H9NO5
Exact Mass 199.048072 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID A57NFDRGBT0
Name 2-[(5-methylol-2-furoyl)amino]acetic acid
Alternate Name(s) 2-[[5-(hydroxymethyl)furan-2-carbonyl]amino]acetic acid 2-[[5-(hydroxymethyl)furan-2-yl]carbonylamino]ethanoic acid 2-[[[5-(hydroxymethyl)-2-furanyl]-oxomethyl]amino]acetic acid
CAS Registry Number 38716-68-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H9NO5
InChI InChI=1S/C8H9NO5/c10-4-5-1-2-6(14-5)8(13)9-3-7(11)12/h1-2,10H,3-4H2,(H,9,13)(H,11,12)
InChIKey HBULKUDERNWOBN-UHFFFAOYSA-N
Molecular Weight 199.162 g/mol
SMILES OCc1oc(C(NCC(=O)O)=O)cc1
SPLASH splash10-0fbc-5900000000-9b44521b6dc17990d9fb
Source of Spectrum EP-1689-0-0
Wiley ID 1196487