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4-amino-2-(p-chlorophenyl)-6,7,8,9-tetrahydro-5H-cyclohepta[4,5]thieno[2,3-d]pyrimidine
SpectraBase Compound ID 4N08IiHNn74
InChI InChI=1S/C17H16ClN3S/c18-11-8-6-10(7-9-11)16-20-15(19)14-12-4-2-1-3-5-13(12)22-17(14)21-16/h6-9H,1-5H2,(H2,19,20,21)
InChIKey JTKAPNKPJVQALH-UHFFFAOYSA-N
Mol Weight 329.85 g/mol
Molecular Formula C17H16ClN3S
Exact Mass 329.075346 g/mol

13C Nuclear Magnetic Resonance (NMR) Spectrum

13C Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID BT98Tv2HzRJ
Name 4-AMINO-2-(p-CHLOROPHENYL)-6,7,8,9-TETRAHYDRO-5H-CYCLOHEPTA[4,5]-THIENO[2,3-d]PYRIMIDINE
Source of Sample Maybridge Chemical Company Ltd., North Cornwall, England
Comments Tentative assignment
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H16ClN3S
InChI InChI=1S/C17H16ClN3S/c18-11-8-6-10(7-9-11)16-20-15(19)14-12-4-2-1-3-5-13(12)22-17(14)21-16/h6-9H,1-5H2,(H2,19,20,21)
InChIKey JTKAPNKPJVQALH-UHFFFAOYSA-N
Melting Point 187C
Molecular Weight 329.85
Solvent Polysol; Reference=TMS Spectrometer= Varian CFT-20
Synonyms 5H-CYCLOHEPTA/4,5/THIENO/2,3-D/PYRIMIDINE, 4-AMINO-2-/P-CHLOROPHENYL/- 6,7,8,9-TETRAHYDRO-,