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JCKJIYACBBECQA-UHFFFAOYSA-N

View entire compound with spectra: 2 NMR

JCKJIYACBBECQA-UHFFFAOYSA-N
SpectraBase Compound ID D9xp1w9Xt23
InChI InChI=1S/C21H25N3O3S/c1-3-11-22-13-17(25)14-23-15(2)19(20(26)18-10-7-12-28-18)21(27)24(23)16-8-5-4-6-9-16/h4-10,12,17,22,25H,3,11,13-14H2,1-2H3
InChIKey JCKJIYACBBECQA-UHFFFAOYSA-N
Mol Weight 399.51 g/mol
Molecular Formula C21H25N3O3S
Exact Mass 399.161663 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7bwI0UqwFu2
Name JCKJIYACBBECQA-UHFFFAOYSA-N
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H25N3O3S
InChI InChI=1S/C21H25N3O3S/c1-3-11-22-13-17(25)14-23-15(2)19(20(26)18-10-7-12-28-18)21(27)24(23)16-8-5-4-6-9-16/h4-10,12,17,22,25H,3,11,13-14H2,1-2H3
InChIKey JCKJIYACBBECQA-UHFFFAOYSA-N
Literature Reference Author ORGANIC_CHEMISTRY_(NMR-DEPARTMENT);UNIVERSITY_MAINZ
Literature Reference Citation UNI_MAINZ,INTERNAL_DB(2007)
Molecular Weight 399.508 g/mol
Source File Reference MHKO16014