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2-Naphthalen-1-yl-N-(5-propyl-[1,3,4]thiadiazol-2-yl)-acetamide
SpectraBase Compound ID 16ptnT7ys4M
InChI InChI=1S/C17H17N3OS/c1-2-6-16-19-20-17(22-16)18-15(21)11-13-9-5-8-12-7-3-4-10-14(12)13/h3-5,7-10H,2,6,11H2,1H3,(H,18,20,21)
InChIKey NXPVNLSEWSWQOO-UHFFFAOYSA-N
Mol Weight 311.4 g/mol
Molecular Formula C17H17N3OS
Exact Mass 311.109233 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID AQ4TtcsuDnP
Name 2-Naphthalen-1-yl-N-(5-propyl-[1,3,4]thiadiazol-2-yl)-acetamide
Comments Computed using HOSE algorithm
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Exact Mass 311.109233352 u
Formula C17H17N3OS
InChI InChI=1S/C17H17N3OS/c1-2-6-16-19-20-17(22-16)18-15(21)11-13-9-5-8-12-7-3-4-10-14(12)13/h3-5,7-10H,2,6,11H2,1H3,(H,18,20,21)
InChIKey NXPVNLSEWSWQOO-UHFFFAOYSA-N
Molecular Weight 311.403 g/mol
SMILES C1=CC=C2C(=C1)C(=CC=C2)CC(NC=1SC(CCC)=NN1)=O