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Sarcosine, N-(2,6-difluorobenzoyl)-, propyl ester
SpectraBase Compound ID 4We5H00Teqj
InChI InChI=1S/C13H15F2NO3/c1-3-7-19-11(17)8-16(2)13(18)12-9(14)5-4-6-10(12)15/h4-6H,3,7-8H2,1-2H3
InChIKey KWPIFXGJDORBCR-UHFFFAOYSA-N
Mol Weight 271.26 g/mol
Molecular Formula C13H15F2NO3
Exact Mass 271.102 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KetQvHoCioN
Name Sarcosine, N-(2,6-difluorobenzoyl)-, propyl ester
Comments Computed using HOSE algorithm
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Exact Mass 271.101999670 u
Formula C13H15F2NO3
InChI InChI=1S/C13H15F2NO3/c1-3-7-19-11(17)8-16(2)13(18)12-9(14)5-4-6-10(12)15/h4-6H,3,7-8H2,1-2H3
InChIKey KWPIFXGJDORBCR-UHFFFAOYSA-N
Molecular Weight 271.264 g/mol
SMILES C1(=CC=CC(=C1C(N(CC(OCCC)=O)C)=O)F)F