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Acetamide, 2-(2-thiophenyl)-N-benzyl-N-tetradecyl-
SpectraBase Compound ID 6Q2vf9KFByE
InChI InChI=1S/C27H41NOS/c1-2-3-4-5-6-7-8-9-10-11-12-16-21-28(24-25-18-14-13-15-19-25)27(29)23-26-20-17-22-30-26/h13-15,17-20,22H,2-12,16,21,23-24H2,1H3
InChIKey RPBBAABYCAFCIL-UHFFFAOYSA-N
Mol Weight 427.7 g/mol
Molecular Formula C27H41NOS
Exact Mass 427.290886 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID EnjmCdWB5p0
Name Acetamide, 2-(2-thiophenyl)-N-benzyl-N-tetradecyl-
Comments Computed using HOSE algorithm
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Exact Mass 427.290886117 u
Formula C27H41NOS
InChI InChI=1S/C27H41NOS/c1-2-3-4-5-6-7-8-9-10-11-12-16-21-28(24-25-18-14-13-15-19-25)27(29)23-26-20-17-22-30-26/h13-15,17-20,22H,2-12,16,21,23-24H2,1H3
InChIKey RPBBAABYCAFCIL-UHFFFAOYSA-N
Molecular Weight 427.691 g/mol
SMILES C(N(CCCCCCCCCCCCCC)CC1=CC=CC=C1)(=O)CC=1SC=CC1