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Sarcosine, N-pentafluorobenzoyl-, ethyl ester
SpectraBase Compound ID 32AJlviRyOz
InChI InChI=1S/C12H10F5NO3/c1-3-21-5(19)4-18(2)12(20)6-7(13)9(15)11(17)10(16)8(6)14/h3-4H2,1-2H3
InChIKey CIUFHJXMOVARRA-UHFFFAOYSA-N
Mol Weight 311.21 g/mol
Molecular Formula C12H10F5NO3
Exact Mass 311.058084 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FfrqfdzsvmR
Name Sarcosine, N-pentafluorobenzoyl-, ethyl ester
Comments Computed using HOSE algorithm
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Exact Mass 311.058083998 u
Formula C12H10F5NO3
InChI InChI=1S/C12H10F5NO3/c1-3-21-5(19)4-18(2)12(20)6-7(13)9(15)11(17)10(16)8(6)14/h3-4H2,1-2H3
InChIKey CIUFHJXMOVARRA-UHFFFAOYSA-N
Molecular Weight 311.208 g/mol
SMILES CCOC(CN(C(=O)C1=C(C(=C(C(=C1F)F)F)F)F)C)=O