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Hexanoyl glycine, ethyl ester
SpectraBase Compound ID KLYxRp3syKs
InChI InChI=1S/C10H19NO3/c1-3-5-6-7-9(12)11-8-10(13)14-4-2/h3-8H2,1-2H3,(H,11,12)
InChIKey VKYLNHGVYMAWGB-UHFFFAOYSA-N
Mol Weight 201.27 g/mol
Molecular Formula C10H19NO3
Exact Mass 201.136493 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KS8wg5jQMPM
Name Hexanoyl glycine, ethyl ester
Comments Computed using HOSE algorithm
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Exact Mass 201.136493473 u
Formula C10H19NO3
InChI InChI=1S/C10H19NO3/c1-3-5-6-7-9(12)11-8-10(13)14-4-2/h3-8H2,1-2H3,(H,11,12)
InChIKey VKYLNHGVYMAWGB-UHFFFAOYSA-N
Molecular Weight 201.266 g/mol
SMILES C(NC(CCCCC)=O)C(=O)OCC