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2-thio-2-[5,7,7-trimethyl-2-(1,3,3-trimethylbutyl)octyl]pseudourea, monohydrobromide

View entire compound with spectra: 2 NMR, and 1 FTIR

2-thio-2-[5,7,7-trimethyl-2-(1,3,3-trimethylbutyl)octyl]pseudourea, monohydrobromide
SpectraBase Compound ID ETVKLJrCRmD
InChI InChI=1S/C19H40N2S.BrH/c1-14(11-18(3,4)5)9-10-16(13-22-17(20)21)15(2)12-19(6,7)8;/h14-16H,9-13H2,1-8H3,(H3,20,21);1H
InChIKey OGADKJYMSITMBC-UHFFFAOYSA-N
Mol Weight 409.5 g/mol
Molecular Formula C19H41BrN2S
Exact Mass 408.217384 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 7GH8bMtMJ75
Name 2-THIO-2-[5,7,7-TRIMETHYL-2-(1,3,3-TRIMETHYLBUTYL)OCTYL]PSEUDOUREA, MONOHYDROBROMIDE
Source of Sample Aldrich Chemical Company, Inc., Milwaukee, Wisconsin
Copyright Copyright © 1991-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H40N2S + HBr
InChI InChI=1S/C19H40N2S.BrH/c1-14(11-18(3,4)5)9-10-16(13-22-17(20)21)15(2)12-19(6,7)8;/h14-16H,9-13H2,1-8H3,(H3,20,21);1H
InChIKey OGADKJYMSITMBC-UHFFFAOYSA-N
Instrument Name BRUKER AC-300
Molecular Weight 409.53
Solvent Polysol; Reference=TMS; Temperature 297K