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Valeramide, 2-propyl-N-octyl-
SpectraBase Compound ID CyStfVrttsp
InChI InChI=1S/C16H33NO/c1-4-7-8-9-10-11-14-17-16(18)15(12-5-2)13-6-3/h15H,4-14H2,1-3H3,(H,17,18)
InChIKey NOVFBASDFZKAPV-UHFFFAOYSA-N
Mol Weight 255.4 g/mol
Molecular Formula C16H33NO
Exact Mass 255.256215 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2DtRMYC6BsV
Name Valeramide, 2-propyl-N-octyl-
Comments Computed using HOSE algorithm
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Exact Mass 255.256214686 u
Formula C16H33NO
InChI InChI=1S/C16H33NO/c1-4-7-8-9-10-11-14-17-16(18)15(12-5-2)13-6-3/h15H,4-14H2,1-3H3,(H,17,18)
InChIKey NOVFBASDFZKAPV-UHFFFAOYSA-N
Molecular Weight 255.446 g/mol
SMILES CCCC(C(NCCCCCCCC)=O)CCC