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1-(3-chlorobenzo[b]thien-2-yl)-3-(1,1-diethyl-2-propynyl)urea
SpectraBase Compound ID 4RwwRJlH4jN
InChI InChI=1S/C16H17ClN2OS/c1-4-16(5-2,6-3)19-15(20)18-14-13(17)11-9-7-8-10-12(11)21-14/h1,7-10H,5-6H2,2-3H3,(H2,18,19,20)
InChIKey SAAJWZAJCFIFSI-UHFFFAOYSA-N
Mol Weight 320.84 g/mol
Molecular Formula C16H17ClN2OS
Exact Mass 320.075012 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8VPS7cxndg8
Name 1-(3-CHLOROBENZO[b]THIEN-2-YL)-3-(1,1-DIETHYL-2-PROPYNYL)UREA
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 C16H17ClN2OS
InChI InChI=1S/C16H17ClN2OS/c1-4-16(5-2,6-3)19-15(20)18-14-13(17)11-9-7-8-10-12(11)21-14/h1,7-10H,5-6H2,2-3H3,(H2,18,19,20)
InChIKey SAAJWZAJCFIFSI-UHFFFAOYSA-N
Melting Point 208-210C
Molecular Weight 320.84
Solvent Polysol; Reference=TMS Spectrometer= Varian CFT-20
Synonyms UREA, 1-/3-CHLOROBENZO/B/THIEN- 2-YL/-3-/1,1-DIETHYL-2-PROPYNYL/-,