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3'-ethyl-2-{[4-(p-methoxyphenyl)-5-(3,4,5-trimethoxyphenyl)-4H-1,2,4-triazole-3-yl]thio}-5',6',',8'-tetrahydro-5',',8',8'-tetramethyl-2'-acetonaphthone

View entire compound with spectra: 2 NMR

3'-ethyl-2-{[4-(p-methoxyphenyl)-5-(3,4,5-trimethoxyphenyl)-4H-1,2,4-triazole-3-yl]thio}-5',6',',8'-tetrahydro-5',',8',8'-tetramethyl-2'-acetonaphthone
SpectraBase Compound ID JQcFRjL8DWp
InChI InChI=1S/C36H43N3O5S/c1-10-22-17-27-28(36(4,5)16-15-35(27,2)3)20-26(22)29(40)21-45-34-38-37-33(39(34)24-11-13-25(41-6)14-12-24)23-18-30(42-7)32(44-9)31(19-23)43-8/h11-14,17-20H,10,15-16,21H2,1-9H3
InChIKey LQUHGEGUQDINDY-UHFFFAOYSA-N
Mol Weight 629.8 g/mol
Molecular Formula C36H43N3O5S
Exact Mass 629.292343 g/mol

1H Nuclear Magnetic Resonance (NMR) Chemical Shifts

1H Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2CuF5mQSoLM
Name 3'-ethyl-2-{[4-(p-methoxyphenyl)-5-(3,4,5-trimethoxyphenyl)-4H-1,2,4-triazole-3-yl]thio}-5',6',',8'-tetrahydro-5',',8',8'-tetramethyl-2'-acetonaphthone
Copyright Copyright © 2009-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C36H43N3O5S
InChI InChI=1S/C36H43N3O5S/c1-10-22-17-27-28(36(4,5)16-15-35(27,2)3)20-26(22)29(40)21-45-34-38-37-33(39(34)24-11-13-25(41-6)14-12-24)23-18-30(42-7)32(44-9)31(19-23)43-8/h11-14,17-20H,10,15-16,21H2,1-9H3
InChIKey LQUHGEGUQDINDY-UHFFFAOYSA-N
Instrument Name Varian A-60
Sadtler NMR Number 23477M
Solvent CDCl3