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1-(1-ADAMANTYL)-3-BROMO-5-NITRO-1,2,4-TRIAZOLE
SpectraBase Compound ID 4qSUHeaNO6C
InChI InChI=1S/C12H15BrN4O2/c13-10-14-11(17(18)19)16(15-10)12-4-7-1-8(5-12)3-9(2-7)6-12/h7-9H,1-6H2/t7-,8+,9-,12-
InChIKey XHBXIPQVVVQUFF-VJTPGPCFSA-N
Mol Weight 327.18 g/mol
Molecular Formula C12H15BrN4O2
Exact Mass 326.037839 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8pcCIGKJEq8
Name 1-(1-ADAMANTYL)-3-BROMO-5-NITRO-1,2,4-TRIAZOLE
Compound Number VII-B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C12H15BrN4O2
InChI InChI=1S/C12H15BrN4O2/c13-10-14-11(17(18)19)16(15-10)12-4-7-1-8(5-12)3-9(2-7)6-12/h7-9H,1-6H2/t7-,8+,9-,12-
InChIKey XHBXIPQVVVQUFF-VJTPGPCFSA-N
Literature Reference Author V.V.SARAEV,T.P.KANAKINA,M.S.PEVZNER,E.L.GOLOD,B.I.UGRAK,V.V. KACHALA
Literature Reference Citation CHEM.HET.COMP.,32,928(1996)
Literature Reference DOI 10.1007/bf01176969
Molecular Weight 327.181 g/mol
Solvent CDCl3
Source File Reference UWMZ14694