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4-(p-Chlorophenyl)-5-(cyclopropylcarbonyl)-4,5,6,7-tetrahydrothieno[3,2-C]pyridine

View entire compound with spectra: 2 NMR, and 1 FTIR

4-(p-Chlorophenyl)-5-(cyclopropylcarbonyl)-4,5,6,7-tetrahydrothieno[3,2-C]pyridine
SpectraBase Compound ID 2ewCn4eR1r7
InChI InChI=1S/C17H16ClNOS/c18-13-5-3-11(4-6-13)16-14-8-10-21-15(14)7-9-19(16)17(20)12-1-2-12/h3-6,8,10,12,16H,1-2,7,9H2
InChIKey RJGSCKOJCQHSQB-UHFFFAOYSA-N
Mol Weight 317.83 g/mol
Molecular Formula C17H16ClNOS
Exact Mass 317.064113 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LDlDJdnHrQ9
Name 4-(p-Chlorophenyl)-5-(cyclopropylcarbonyl)-4,5,6,7-tetrahydrothieno[3,2-C]pyridine
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 317.064113012 u
Formula C17H16ClNOS
InChI InChI=1S/C17H16ClNOS/c18-13-5-3-11(4-6-13)16-14-8-10-21-15(14)7-9-19(16)17(20)12-1-2-12/h3-6,8,10,12,16H,1-2,7,9H2
InChIKey RJGSCKOJCQHSQB-UHFFFAOYSA-N
Molecular Weight 317.834 g/mol
SMILES C=12C(N(CCC1SC=C2)C(C1CC1)=O)C=1C=CC(=CC1)Cl