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Allantoic acid
SpectraBase Compound ID 4pIJ9G2ZMVH
InChI InChI=1S/C4H8N4O4/c5-3(11)7-1(2(9)10)8-4(6)12/h1H,(H,9,10)(H3,5,7,11)(H3,6,8,12)
InChIKey NUCLJNSWZCHRKL-UHFFFAOYSA-N
Mol Weight 176.13 g/mol
Molecular Formula C4H8N4O4
Exact Mass 176.054555 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HBu53AmMPiU
Name Allantoic acid
Alternate Name(s) Acetic acid, bis[(aminocarbonyl)amino]- Bis[(aminocarbonyl)amino]acetic acid Diureidoacetic acid 2,2-bis(carbamoylamino)acetic acid 2,2-bis(aminocarbonylamino)ethanoic acid
CAS Registry Number 99-16-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C4H8N4O4
InChI InChI=1S/C4H8N4O4/c5-3(11)7-1(2(9)10)8-4(6)12/h1H,(H,9,10)(H3,5,7,11)(H3,6,8,12)
InChIKey NUCLJNSWZCHRKL-UHFFFAOYSA-N
Molecular Weight 176.132 g/mol
SMILES N(C(C(O)=O)NC(N)=O)C(=O)N
SPLASH splash10-0006-9000000000-f542528c551dfbb7c325
Source of Spectrum NP-17-5869-0
Wiley ID 1101625