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BUMQOBYUWYALFL-UHFFFAOYSA-M

View entire compound with spectra: 1 NMR

BUMQOBYUWYALFL-UHFFFAOYSA-M
SpectraBase Compound ID J0vP7jiCxss
InChI InChI=1S/C9H9BN6.C7H6.BrH.O.W/c1-4-11-14(7-1)10(15-8-2-5-12-15)16-9-3-6-13-16;1-7-5-3-2-4-6-7;;;/h1-9H;1-6H;1H;;/q;;;;+1/p-1
InChIKey BUMQOBYUWYALFL-UHFFFAOYSA-M
Mol Weight 581.9 g/mol
Molecular Formula C16H15BBrN6OW
Exact Mass 581.00931 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID AKEvKYMN1HE
Name BUMQOBYUWYALFL-UHFFFAOYSA-M
Compound Number 1D
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C16H15BBrN6OW
InChI InChI=1S/C9H9BN6.C7H6.BrH.O.W/c1-4-11-14(7-1)10(15-8-2-5-12-15)16-9-3-6-13-16;1-7-5-3-2-4-6-7;;;/h1-9H;1-6H;1H;;/q;;;;+1/p-1
InChIKey BUMQOBYUWYALFL-UHFFFAOYSA-M
Literature Reference Author S.AHN,A.MAYR
Literature Reference Citation J.AM.CHEM.SOC.,118,7408(1996)
Literature Reference DOI 10.1021/ja960438s
Molecular Weight 581.899 g/mol
Sample ID 36094
Solvent CD2Cl2