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(3-S)-3-[((3-AMINO-3-CARBOXY)-PROPYL)-(HYDROXY)-PHOSPHINYL]-3-TRIFLUOROMETHYLPROPANOIC_ACID;LSP1-1191
SpectraBase Compound ID DuKkZmQw3Xa
InChI InChI=1S/C8H13F3NO6P/c9-8(10,11)5(3-6(13)14)19(17,18)2-1-4(12)7(15)16/h4-5H,1-3,12H2,(H,13,14)(H,15,16)(H,17,18)/t4-,5?/m0/s1
InChIKey BKCHYPGHBXGCNX-ROLXFIACSA-N
Mol Weight 307.16 g/mol
Molecular Formula C8H13F3NO6P
Exact Mass 307.043259 g/mol

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID gwgHLGNR3T
Name (3-S)-3-[((3-AMINO-3-CARBOXY)-PROPYL)-(HYDROXY)-PHOSPHINYL]-3-TRIFLUOROMETHYLPROPANOIC_ACID;LSP1-1191
Compound Number 9
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C8H12F3NO6P
InChI InChI=1S/C8H13F3NO6P/c9-8(10,11)5(3-6(13)14)19(17,18)2-1-4(12)7(15)16/h4-5H,1-3,12H2,(H,13,14)(H,15,16)(H,17,18)/t4-,5?/m0/s1
InChIKey BKCHYPGHBXGCNX-ROLXFIACSA-N
Literature Reference Author C.SELVAM,N.OUESLATI,I.A.LEMASSON,I.BRABER,D.RIGAULT,T.COURTI OL,S.CESARINI,N.TRIB
Literature Reference Citation J.MED.CHEM.,53,2797(2010)
Literature Reference DOI 10.1021/jm901523t
Solvent D2O
Source File Reference UWMZ46465