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Carbonic acid, monoamide, N-benzyl-N-heptyl-, 2,2,2-trichloroethyl ester

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Carbonic acid, monoamide, N-benzyl-N-heptyl-, 2,2,2-trichloroethyl ester
SpectraBase Compound ID Dcg5KakfrrU
InChI InChI=1S/C17H24Cl3NO2/c1-2-3-4-5-9-12-21(13-15-10-7-6-8-11-15)16(22)23-14-17(18,19)20/h6-8,10-11H,2-5,9,12-14H2,1H3
InChIKey FKXRRUUXZJEMOY-UHFFFAOYSA-N
Mol Weight 380.74 g/mol
Molecular Formula C17H24Cl3NO2
Exact Mass 379.087262 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID K3kzDGyYwA0
Name Carbonic acid, monoamide, N-benzyl-N-heptyl-, 2,2,2-trichloroethyl ester
Comments Computed using HOSE algorithm
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Exact Mass 379.087262115 u
Formula C17H24Cl3NO2
InChI InChI=1S/C17H24Cl3NO2/c1-2-3-4-5-9-12-21(13-15-10-7-6-8-11-15)16(22)23-14-17(18,19)20/h6-8,10-11H,2-5,9,12-14H2,1H3
InChIKey FKXRRUUXZJEMOY-UHFFFAOYSA-N
Molecular Weight 380.743 g/mol
SMILES C(N(CCCCCCC)CC1=CC=CC=C1)(=O)OCC(Cl)(Cl)Cl