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3,5-bis{{[(3-ethyl-5,6,7,8-tetrahydro-5,5,8,8-tetramethyl-2-naphthyl)-carbonyl]methyl}thio}-4-isothiazolecarbonitrile
SpectraBase Compound ID EqTRHdFJION
InChI InChI=1S/C40H50N2O2S3/c1-11-24-17-29-31(39(7,8)15-13-37(29,3)4)19-26(24)33(43)22-45-35-28(21-41)36(47-42-35)46-23-34(44)27-20-32-30(18-25(27)12-2)38(5,6)14-16-40(32,9)10/h17-20H,11-16,22-23H2,1-10H3
InChIKey HBJKPBYZTSPIFU-UHFFFAOYSA-N
Mol Weight 687.0 g/mol
Molecular Formula C40H50N2O2S3
Exact Mass 686.303442 g/mol
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Source of Sample Maybridge Chemical Company Ltd., North Cornwall, England
Solvent Chloroform-d; Reference=TMS Spectrometer= Varian CFT-20
Copyright Copyright © 2009-2024 John Wiley & Sons, Inc. All Rights Reserved.
Solvent CDCl3
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Source of Sample MAYBRIDGE CHEMICAL COMPANY LTD., NORTH CORNWALL, ENGLAND
Catalog Number CD 469
Technique KBr WAFER
Copyright Copyright © 2008-2024 John Wiley & Sons, Inc. All Rights Reserved.
Solvent Methanol
  • 4-ISOTHIAZOLECARBONITRILE, 3,5-BIS- ////3-ETHYL-5,6,7,8-TETRAHYDRO- 5,5,8,8-TETRAMETHYL-2-NAPHTHYL/- CARBONYL/METHYL/THIO/-,
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