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Carbonic acid, monoamide, N-benzyl-N-butyl-, hexyl ester
SpectraBase Compound ID 3k8x8fGzOa0
InChI InChI=1S/C18H29NO2/c1-3-5-7-11-15-21-18(20)19(14-6-4-2)16-17-12-9-8-10-13-17/h8-10,12-13H,3-7,11,14-16H2,1-2H3
InChIKey SXMSNICXSXAMTQ-UHFFFAOYSA-N
Mol Weight 291.44 g/mol
Molecular Formula C18H29NO2
Exact Mass 291.219829 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JxcADWiyN3S
Name Carbonic acid, monoamide, N-benzyl-N-butyl-, hexyl ester
Comments Computed using HOSE algorithm
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Exact Mass 291.219829176 u
Formula C18H29NO2
InChI InChI=1S/C18H29NO2/c1-3-5-7-11-15-21-18(20)19(14-6-4-2)16-17-12-9-8-10-13-17/h8-10,12-13H,3-7,11,14-16H2,1-2H3
InChIKey SXMSNICXSXAMTQ-UHFFFAOYSA-N
SMILES CCCCCCOC(=O)N(CCCC)CC1=CC=CC=C1