For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
1-[3-(2,6-dichlorophenyl)-5-methyl-4-isoxazolyl]-3-(2-methyl-m-dithian-5-yl)urea
SpectraBase Compound ID B4g6CMyN8hW
InChI InChI=1S/C16H17Cl2N3O2S2/c1-8-14(20-16(22)19-10-6-24-9(2)25-7-10)15(21-23-8)13-11(17)4-3-5-12(13)18/h3-5,9-10H,6-7H2,1-2H3,(H2,19,20,22)
InChIKey VNYVMIMPWGZDPU-UHFFFAOYSA-N
Mol Weight 418.36 g/mol
Molecular Formula C16H17Cl2N3O2S2
Exact Mass 417.013925 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 1Ak30WtzL2B
Name 1-[3-(2,6-DICHLOROPHENYL)-5-METHYL-4-ISOXAZOLYL]-3-(2-METHYL-m-DITHIAN-5-YL)UREA
Source of Sample Maybridge Chemical Company Ltd., North Cornwall, England
Copyright Copyright © 1991-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H17Cl2N3O2S2
InChI InChI=1S/C16H17Cl2N3O2S2/c1-8-14(20-16(22)19-10-6-24-9(2)25-7-10)15(21-23-8)13-11(17)4-3-5-12(13)18/h3-5,9-10H,6-7H2,1-2H3,(H2,19,20,22)
InChIKey VNYVMIMPWGZDPU-UHFFFAOYSA-N
Instrument Name BRUKER AC-300
Melting Point 190-193C
Molecular Weight 418.36
Solvent CDCl3; Reference=TMS; Temperature 297K