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4-(4,6-Difluoro-pyrimidin-2-ylamino)-butyric acid
SpectraBase Compound ID 6IbQbeSM8XX
InChI InChI=1S/C8H9F2N3O2/c9-5-4-6(10)13-8(12-5)11-3-1-2-7(14)15/h4H,1-3H2,(H,14,15)(H,11,12,13)
InChIKey UNJNYBFFPCZPKH-UHFFFAOYSA-N
Mol Weight 217.18 g/mol
Molecular Formula C8H9F2N3O2
Exact Mass 217.066283 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Im23hEsm0E1
Name 4-(4,6-Difluoro-pyrimidin-2-ylamino)-butyric acid
Alternate Name(s) 4-[(4,6-Difluoro-2-pyrimidinyl)amino]butanoic acid 4-[(4,6-difluoropyrimidin-2-yl)amino]butanoic acid 4-[[4,6-bis(fluoranyl)pyrimidin-2-yl]amino]butanoic acid
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Formula C8H9F2N3O2
InChI InChI=1S/C8H9F2N3O2/c9-5-4-6(10)13-8(12-5)11-3-1-2-7(14)15/h4H,1-3H2,(H,14,15)(H,11,12,13)
InChIKey UNJNYBFFPCZPKH-UHFFFAOYSA-N
Molecular Weight 217.176 g/mol
SMILES OC(CCCNc1nc(cc(n1)F)F)=O
SPLASH splash10-0006-3900000000-8e43258c9a8b2d952cc3
Wiley ID 1464021