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3-(2-HYDROXY-5-BROMOBENZYL)-1,5,9-TRIAZA-CYCLODECAN
SpectraBase Compound ID b5CLJJXWeD
InChI InChI=1S/C16H26BrN3O/c17-15-3-4-16(21)14(10-15)9-13-11-19-7-1-5-18-6-2-8-20-12-13/h3-4,10,13,18-21H,1-2,5-9,11-12H2
InChIKey HBPYVGRZCOPDHG-UHFFFAOYSA-N
Mol Weight 356.31 g/mol
Molecular Formula C16H26BrN3O
Exact Mass 355.125925 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DPWHkGnxlG4
Name 3-(2-HYDROXY-5-BROMOBENZYL)-1,5,9-TRIAZA-CYCLODECAN
Compound Number 2
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C16H26BrN3O/c17-15-3-4-16(21)14(10-15)9-13-11-19-7-1-5-18-6-2-8-20-12-13/h3-4,10,13,18-21H,1-2,5-9,11-12H2
InChIKey HBPYVGRZCOPDHG-UHFFFAOYSA-N
Literature Reference G.B.BATES,D.PARKER J.CHEM.SOC.PERKIN-2,1109(1996)
Solvent Chloroform-d