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(Phenylthio) acetamide, N-(2-phenylethyl)-N-(2-ethylhexyl)-
SpectraBase Compound ID LjFaeI6lVPz
InChI InChI=1S/C24H33NOS/c1-3-5-12-21(4-2)19-25(18-17-22-13-8-6-9-14-22)24(26)20-27-23-15-10-7-11-16-23/h6-11,13-16,21H,3-5,12,17-20H2,1-2H3
InChIKey WVRHQVFZZYZCHL-UHFFFAOYSA-N
Mol Weight 383.6 g/mol
Molecular Formula C24H33NOS
Exact Mass 383.228286 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HCAwAGmXnf1
Name (Phenylthio) acetamide, N-(2-phenylethyl)-N-(2-ethylhexyl)-
Comments Computed using HOSE algorithm
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Exact Mass 383.228285860 u
Formula C24H33NOS
InChI InChI=1S/C24H33NOS/c1-3-5-12-21(4-2)19-25(18-17-22-13-8-6-9-14-22)24(26)20-27-23-15-10-7-11-16-23/h6-11,13-16,21H,3-5,12,17-20H2,1-2H3
InChIKey WVRHQVFZZYZCHL-UHFFFAOYSA-N
Molecular Weight 383.594 g/mol
SMILES C1=CC=C(C=C1)SCC(N(CC(CCCC)CC)CCC1=CC=CC=C1)=O