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UR-144 degradant
SpectraBase Compound ID ADPgrfUZXd9
InChI InChI=1S/C21H29NO/c1-6-7-10-13-22-15-18(17-11-8-9-12-19(17)22)20(23)14-21(4,5)16(2)3/h8-9,11-12,15H,2,6-7,10,13-14H2,1,3-5H3
InChIKey NBJHWTCAQOYUND-UHFFFAOYSA-N
Mol Weight 311.47 g/mol
Molecular Formula C21H29NO
Exact Mass 311.224915 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Cq74ibWsZws
Name 3,3,4-TRIMETHYL-1-(1-PENTYL-1H-INDOL-3-YL)-PENT-4-EN-1-ONE;TMCP-018;THERMAL-ISOMER
Compound Number 10
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H29NO
InChI InChI=1S/C21H29NO/c1-6-7-10-13-22-15-18(17-11-8-9-12-19(17)22)20(23)14-21(4,5)16(2)3/h8-9,11-12,15H,2,6-7,10,13-14H2,1,3-5H3
InChIKey NBJHWTCAQOYUND-UHFFFAOYSA-N
Literature Reference Author V.SHEVYRIN,V.MELKOZEROV,A.NEVERO,O.ELTSOV,Y.MORZHERIN,Y.SHAF RAN
Literature Reference Citation FOR.SCI.INT.,226,62(2013)
Literature Reference DOI 10.1016/j.forsciint.2012.12.009
Molecular Weight 311.467 g/mol
Source File Reference UWLU75020