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1-(2-cyanoethyl)-1-cyclohexyl-2-thio-3-(3,4-xylyl)urea
SpectraBase Compound ID 8pO2xlQc23m
InChI InChI=1S/C18H25N3S/c1-14-9-10-16(13-15(14)2)20-18(22)21(12-6-11-19)17-7-4-3-5-8-17/h9-10,13,17H,3-8,12H2,1-2H3,(H,20,22)
InChIKey SAZYQWDNMRQLFI-UHFFFAOYSA-N
Mol Weight 315.48 g/mol
Molecular Formula C18H25N3S
Exact Mass 315.176919 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5Gtt2rIJeAa
Name 1-(2-CYANOETHYL)-1-CYCLOHEXYL-2-THIO-3-(3,4-XYLYL)UREA
Source of Sample Maybridge Chemical Company Ltd., North Cornwall, England
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H25N3S
InChI InChI=1S/C18H25N3S/c1-14-9-10-16(13-15(14)2)20-18(22)21(12-6-11-19)17-7-4-3-5-8-17/h9-10,13,17H,3-8,12H2,1-2H3,(H,20,22)
InChIKey SAZYQWDNMRQLFI-UHFFFAOYSA-N
Melting Point 139-140C
Molecular Weight 315.48
Solvent Polysol; Reference=TMS Spectrometer= Varian CFT-20
Synonyms UREA, 1-/2-CYANOETHYL/-1-CYCLOHEXYL-2-THIO-3-/3,4-XYLYL/-,