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[(2,6-Difluoro-4-pyrimidinyl)amino]acetic acid
SpectraBase Compound ID oQYxuQdbbJ
InChI InChI=1S/C6H5F2N3O2/c7-3-1-4(9-2-5(12)13)11-6(8)10-3/h1H,2H2,(H,12,13)(H,9,10,11)
InChIKey LLMMBHLJZPPNJY-UHFFFAOYSA-N
Mol Weight 189.12 g/mol
Molecular Formula C6H5F2N3O2
Exact Mass 189.034983 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID F1ZXENtdb3O
Name [(2,6-Difluoro-4-pyrimidinyl)amino]acetic acid
CAS Registry Number 205817-04-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C6H5F2N3O2
InChI InChI=1S/C6H5F2N3O2/c7-3-1-4(9-2-5(12)13)11-6(8)10-3/h1H,2H2,(H,12,13)(H,9,10,11)
InChIKey LLMMBHLJZPPNJY-UHFFFAOYSA-N
Molecular Weight 189.122 g/mol
SMILES OC(CNc1nc(nc(c1)F)F)=O
SPLASH splash10-0007-2900000000-fa89427a999d22f57077
Synonyms (2,6-Difluoro-pyrimidin-4-ylamino)-acetic acid 2-[(2,6-difluoro-4-pyrimidinyl)amino]acetic acid 2-[(2,6-difluoropyrimidin-4-yl)amino]acetic acid 2-[[2,6-bis(fluoranyl)pyrimidin-4-yl]amino]ethanoic acid
Wiley ID 1462916