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N-[(2,4-dioxo-5-fluoro-1,2,3,4-tetrahydro-1-pyrimidinyl)carbonyl]methionine, ethyl ester
SpectraBase Compound ID HZN1dmXmqEX
InChI InChI=1S/C12H16FN3O5S/c1-3-21-10(18)8(4-5-22-2)14-11(19)16-6-7(13)9(17)15-12(16)20/h6,8H,3-5H2,1-2H3,(H,14,19)(H,15,17,20)
InChIKey KPKASMTWPNELHY-UHFFFAOYSA-N
Mol Weight 333.33 g/mol
Molecular Formula C12H16FN3O5S
Exact Mass 333.07947 g/mol

13C Nuclear Magnetic Resonance (NMR) Spectrum

13C Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID K1NPcCArv7m
Name N-[(2,4-DIOXO-5-FLUORO-1,2,3,4-TETRAHYDRO-1-PYRIMIDINYL)CARBONYL]METHIONINE,ETHYL ESTER
Source of Sample S. Ozaki, Mitsui Toatsu Chemicals, Inc., Yokohama, Japan
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H16FN3O5S
InChI InChI=1S/C12H16FN3O5S/c1-3-21-10(18)8(4-5-22-2)14-11(19)16-6-7(13)9(17)15-12(16)20/h6,8H,3-5H2,1-2H3,(H,14,19)(H,15,17,20)
InChIKey KPKASMTWPNELHY-UHFFFAOYSA-N
Melting Point 104-105C
Molecular Weight 333.34
Solvent Polysol; Reference=TMS Spectrometer= Varian CFT-20
Synonyms METHIONINE, N-//2,4-DIOXO-5-FLUORO- 1,2,3,4-TETRAHYDRO-1-PYRIMIDINYL/CARBONYL/-, ETHYL ESTER