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JAEXYIAXFPZAAX-UHFFFAOYSA-N

View entire compound with spectra: 2 NMR, and 1 MS (GC)

JAEXYIAXFPZAAX-UHFFFAOYSA-N
SpectraBase Compound ID 64eO4K7WL3L
InChI InChI=1S/C15H9BrN4O2/c16-7-1-2-8-9(4-18-10(8)3-7)12-13(11-5-17-6-19-11)15(22)20-14(12)21/h1-6,18H,(H,17,19)(H,20,21,22)
InChIKey JAEXYIAXFPZAAX-UHFFFAOYSA-N
Mol Weight 357.17 g/mol
Molecular Formula C15H9BrN4O2
Exact Mass 355.990889 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID IODOOEgK9AN
Name DIDEMNIMIDE-B
Compound Number 2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C15H9BrN4O2
InChI InChI=1S/C15H9BrN4O2/c16-7-1-2-8-9(4-18-10(8)3-7)12-13(11-5-17-6-19-11)15(22)20-14(12)21/h1-6,18H,(H,17,19)(H,20,21,22)
InChIKey JAEXYIAXFPZAAX-UHFFFAOYSA-N
Literature Reference Author H.C.VERVOORT,S.E.RICHARDS-GROSS,W.FENICAL,A.Y.LEE,J.CLARDY
Literature Reference Citation J.ORG.CHEM.,62,1486(1997)
Literature Reference DOI 10.1021/jo961789s
Molecular Weight 357.166 g/mol
Solvent DMSO-D6
Source File Reference WANG1810