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3-(2-chloro-6-phenoxybenzyl)-1-cyano-2-methyl-2-thiopseudourea

View entire compound with spectra: 3 NMR, and 1 FTIR

3-(2-chloro-6-phenoxybenzyl)-1-cyano-2-methyl-2-thiopseudourea
SpectraBase Compound ID LE7whPmsn6W
InChI InChI=1S/C16H14ClN3OS/c1-22-16(20-11-18)19-10-13-14(17)8-5-9-15(13)21-12-6-3-2-4-7-12/h2-9H,10H2,1H3,(H,19,20)
InChIKey OUQKIOIWXROUAI-UHFFFAOYSA-N
Mol Weight 331.82 g/mol
Molecular Formula C16H14ClN3OS
Exact Mass 331.054611 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 8y0PNwTXUpq
Name 3-(2-CHLORO-6-PHENOXYBENZYL)-1-CYANO-2-METHYL-2-THIOPSEUDOUREA
Source of Sample Maybridge Chemical Company Ltd., North Cornwall, England
Copyright Copyright © 1991-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H14ClN3OS
InChI InChI=1S/C16H14ClN3OS/c1-22-16(20-11-18)19-10-13-14(17)8-5-9-15(13)21-12-6-3-2-4-7-12/h2-9H,10H2,1H3,(H,19,20)
InChIKey OUQKIOIWXROUAI-UHFFFAOYSA-N
Instrument Name BRUKER AC-300
Melting Point 188-190C
Molecular Weight 331.83
Solvent DMSO-d6; Reference=TMS; Temperature 297K