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Carbonic acid, monoamide, N-3-methylbutyl-, benzyl ester
SpectraBase Compound ID 3cO5JMP9ZxT
InChI InChI=1S/C13H19NO2/c1-11(2)8-9-14-13(15)16-10-12-6-4-3-5-7-12/h3-7,11H,8-10H2,1-2H3,(H,14,15)
InChIKey YXOCWKCOEZDYOY-UHFFFAOYSA-N
Mol Weight 221.3 g/mol
Molecular Formula C13H19NO2
Exact Mass 221.141579 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JDSKitOFNE
Name Carbonic acid, monoamide, N-3-methylbutyl-, benzyl ester
Comments Computed using HOSE algorithm
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Exact Mass 221.141578854 u
Formula C13H19NO2
InChI InChI=1S/C13H19NO2/c1-11(2)8-9-14-13(15)16-10-12-6-4-3-5-7-12/h3-7,11H,8-10H2,1-2H3,(H,14,15)
InChIKey YXOCWKCOEZDYOY-UHFFFAOYSA-N
Molecular Weight 221.300 g/mol
SMILES C(OCC=1C=CC=CC1)(=O)NCCC(C)C