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TVPWGEXUQZCGNV-UHFFFAOYSA-N

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

TVPWGEXUQZCGNV-UHFFFAOYSA-N
SpectraBase Compound ID A0m3HJlv3ym
InChI InChI=1S/C15H17BrN4O4/c1-8(21)17-15-18-20(10(3)23)14(19(15)9(2)22)11-5-6-13(24-4)12(16)7-11/h5-7,14H,1-4H3,(H,17,18,21)
InChIKey TVPWGEXUQZCGNV-UHFFFAOYSA-N
Mol Weight 397.23 g/mol
Molecular Formula C15H17BrN4O4
Exact Mass 396.043318 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DKjmex0h9Ql
Name TVPWGEXUQZCGNV-UHFFFAOYSA-N
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C15H17BrN4O4
InChI InChI=1S/C15H17BrN4O4/c1-8(21)17-15-18-20(10(3)23)14(19(15)9(2)22)11-5-6-13(24-4)12(16)7-11/h5-7,14H,1-4H3,(H,17,18,21)
InChIKey TVPWGEXUQZCGNV-UHFFFAOYSA-N
Literature Reference Author ORGANIC_CHEMISTRY_(NMR-DEPARTMENT);UNIVERSITY_MAINZ
Literature Reference Citation UNI_MAINZ,INTERNAL_DB(2007)
Molecular Weight 397.228 g/mol
Source File Reference MHKO15942