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Carbonic acid, monoamide, N-(2-phenylethyl)-N-heptyl-, hexyl ester

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Carbonic acid, monoamide, N-(2-phenylethyl)-N-heptyl-, hexyl ester
SpectraBase Compound ID JjjWquGp0j6
InChI InChI=1S/C22H37NO2/c1-3-5-7-9-13-18-23(19-17-21-15-11-10-12-16-21)22(24)25-20-14-8-6-4-2/h10-12,15-16H,3-9,13-14,17-20H2,1-2H3
InChIKey XKSOISQIDQBESI-UHFFFAOYSA-N
Mol Weight 347.5 g/mol
Molecular Formula C22H37NO2
Exact Mass 347.282429 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DbvQ7e6mIkA
Name Carbonic acid, monoamide, N-(2-phenylethyl)-N-heptyl-, hexyl ester
Comments Computed using HOSE algorithm
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Exact Mass 347.282429433 u
Formula C22H37NO2
InChI InChI=1S/C22H37NO2/c1-3-5-7-9-13-18-23(19-17-21-15-11-10-12-16-21)22(24)25-20-14-8-6-4-2/h10-12,15-16H,3-9,13-14,17-20H2,1-2H3
InChIKey XKSOISQIDQBESI-UHFFFAOYSA-N
Molecular Weight 347.543 g/mol
SMILES C1=CC=CC(=C1)CCN(C(=O)OCCCCCC)CCCCCCC