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5-{[(3-ethyl-5,6,7,8-tetrahydro-5,5,8,8-tetramethyl-2-naphthoyl)methyl]thio}-4-(p-methoxyphenyl)-4H-1,2,4-triazole-3-acetonitrile, monohydrobromide

View entire compound with spectra: 1 FTIR, and 1 UV-Vis

5-{[(3-ethyl-5,6,7,8-tetrahydro-5,5,8,8-tetramethyl-2-naphthoyl)methyl]thio}-4-(p-methoxyphenyl)-4H-1,2,4-triazole-3-acetonitrile, monohydrobromide
SpectraBase Compound ID F1Bfs3tIQaV
InChI InChI=1S/C29H34N4O2S.BrH/c1-7-19-16-23-24(29(4,5)14-13-28(23,2)3)17-22(19)25(34)18-36-27-32-31-26(12-15-30)33(27)20-8-10-21(35-6)11-9-20;/h8-11,16-17H,7,12-14,18H2,1-6H3;1H
InChIKey DSUYBTZDABLLPE-UHFFFAOYSA-N
Mol Weight 583.589 g/mol
Molecular Formula C29H35BrN4O2S
Exact Mass 582.166411 g/mol

Ultraviolet-Visible (UV-Vis) Spectrum

Ultraviolet-Visible (UV-Vis) Spectrum

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SpectraBase Spectrum ID Her8QIv4v0s
Name 5-{[(3-ethyl-5,6,7,8-tetrahydro-5,5,8,8-tetramethyl-2-naphthoyl)methyl]thio}-4-(p-methoxyphenyl)-4H-1,2,4-triazole-3-acetonitrile, monohydrobromide
Conditions Neutral
Copyright Copyright © 2008-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C29H35BrN4O2S
InChI InChI=1S/C29H34N4O2S.BrH/c1-7-19-16-23-24(29(4,5)14-13-28(23,2)3)17-22(19)25(34)18-36-27-32-31-26(12-15-30)33(27)20-8-10-21(35-6)11-9-20;/h8-11,16-17H,7,12-14,18H2,1-6H3;1H
InChIKey DSUYBTZDABLLPE-UHFFFAOYSA-N
Sadtler IR Number 53947
Sadtler UV Number 28486N
Solvent Methanol