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4-phenyl-4,5,6,7-tetrahydro-3H-benzo[6,7]cyclohepta[1,2-d]pyrimidine-2-thiol
SpectraBase Compound ID CHY8Lyfjq3b
InChI InChI=1S/C19H18N2S/c22-19-20-17(14-8-2-1-3-9-14)16-12-6-10-13-7-4-5-11-15(13)18(16)21-19/h1-5,7-9,11,17H,6,10,12H2,(H2,20,21,22)
InChIKey UJBVBYHCCQCGRQ-UHFFFAOYSA-N
Mol Weight 306.43 g/mol
Molecular Formula C19H18N2S
Exact Mass 306.11907 g/mol

Transmission Infrared (IR) Spectrum

Transmission Infrared (IR) Spectrum

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SpectraBase Spectrum ID 6O6ucI5AlDg
Name 4-PHENYL-4,5,6,7-TETRAHYDRO-3H-BENZO[6,7]CYCLOHEPTA[1,2-d]PYRIMIDINE-2-THIOL
Source of Sample A. G. Hammam, National Research Centre, Dokki, Cairo, Egypt
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H18N2S
InChI InChI=1S/C19H18N2S/c22-19-20-17(14-8-2-1-3-9-14)16-12-6-10-13-7-4-5-11-15(13)18(16)21-19/h1-5,7-9,11,17H,6,10,12H2,(H2,20,21,22)
InChIKey UJBVBYHCCQCGRQ-UHFFFAOYSA-N
Literature Reference J. CHEM. ENG. DATA 23, 91(1978) Abstract-Chemical Abstracts= 88, 105261(1978)
Melting Point 270C
Molecular Weight 306.427002
Synonyms 3H-BENZO/6,7/CYCLOHEPTA/1,2-D/- PYRIMIDINE-2-THIOL, 4-PHENYL-4,5,6,7- TETRAHYDRO-,
Technique KBr WAFER