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AKB48

View entire compound with spectra: 3 NMR, 1 FTIR, and 5 MS (GC)

AKB48
SpectraBase Compound ID GYK6Mv5gIvF
InChI InChI=1S/C23H31N3O/c1-2-3-6-9-26-20-8-5-4-7-19(20)21(25-26)22(27)24-23-13-16-10-17(14-23)12-18(11-16)15-23/h4-5,7-8,16-18H,2-3,6,9-15H2,1H3,(H,24,27)/t16-,17+,18-,23-
InChIKey UCTCCIPCJZKWEZ-BRGRSMLUSA-N
Mol Weight 365.52 g/mol
Molecular Formula C23H31N3O
Exact Mass 365.246713 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BOTyYvC8xUz
Name N-(1-ADAMANTYL)-1-PENTYL-1H-INDAZOLE-3-CARBOXAMIDE;AKB48
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C23H31N3O
InChI InChI=1S/C23H31N3O/c1-2-3-6-9-26-20-8-5-4-7-19(20)21(25-26)22(27)24-23-13-16-10-17(14-23)12-18(11-16)15-23/h4-5,7-8,16-18H,2-3,6,9-15H2,1H3,(H,24,27)/t16-,17+,18-,23-
InChIKey UCTCCIPCJZKWEZ-BRGRSMLUSA-N
Literature Reference Author J.AMATO,N.IACCARINO,B.PAGANO,V.COMPAGNONE,F.DIROSA,G.PELUSO, E.NOVELLINO,A.RANDAZ
Literature Reference Citation J.FOR.SCI.CRIM.,1,403(2014)
Molecular Weight 365.519 g/mol
Source File Reference UWLU74637