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Sarcosine, N-pentafluorobenzoyl-, pentyl ester
SpectraBase Compound ID 7HnbuVCwnSU
InChI InChI=1S/C15H16F5NO3/c1-3-4-5-6-24-8(22)7-21(2)15(23)9-10(16)12(18)14(20)13(19)11(9)17/h3-7H2,1-2H3
InChIKey GJJHWKNRAVEFLG-UHFFFAOYSA-N
Mol Weight 353.29 g/mol
Molecular Formula C15H16F5NO3
Exact Mass 353.105034 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6RmId3G9dOU
Name Sarcosine, N-pentafluorobenzoyl-, pentyl ester
Comments Computed using HOSE algorithm
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Exact Mass 353.105034191 u
Formula C15H16F5NO3
InChI InChI=1S/C15H16F5NO3/c1-3-4-5-6-24-8(22)7-21(2)15(23)9-10(16)12(18)14(20)13(19)11(9)17/h3-7H2,1-2H3
InChIKey GJJHWKNRAVEFLG-UHFFFAOYSA-N
Molecular Weight 353.289 g/mol
SMILES CCCCCOC(CN(C(=O)C=1C(F)=C(C(=C(F)C1F)F)F)C)=O