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1-(3-methyladamantan-1-yl)-3-(p-tolylsulfonyl)urea
SpectraBase Compound ID 9cuJ4Zh5ngd
InChI InChI=1S/C19H26N2O3S/c1-13-3-5-16(6-4-13)25(23,24)21-17(22)20-19-10-14-7-15(11-19)9-18(2,8-14)12-19/h3-6,14-15H,7-12H2,1-2H3,(H2,20,21,22)/t14-,15+,18-,19-
InChIKey PXRSBDVYSITCNO-ZNZJMJLKSA-N
Mol Weight 362.49 g/mol
Molecular Formula C19H26N2O3S
Exact Mass 362.166414 g/mol

1H Nuclear Magnetic Resonance (NMR) Chemical Shifts

1H Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BCQbnoistO
Name 1-(3-methyladamantan-1-yl)-3-(p-tolylsulfonyl)urea
Source of Sample K. Gerzon, Lilly Research Laboratories, Indianapolis, Indiana
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Formula C19H26N2O3S
InChI InChI=1S/C19H26N2O3S/c1-13-3-5-16(6-4-13)25(23,24)21-17(22)20-19-10-14-7-15(11-19)9-18(2,8-14)12-19/h3-6,14-15H,7-12H2,1-2H3,(H2,20,21,22)/t14-,15+,18-,19-
InChIKey PXRSBDVYSITCNO-ZNZJMJLKSA-N
Instrument Name Varian A-60
Sadtler NMR Number 2910M
Solvent CDCl3
Synonyms UREA, 1-/3-METHYLADAMANTAN-1-YL/- 3-/P-TOLYLSULFONYL/-,