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(S)-(+)-1-(2-HYDROXYPROPYL)-4-PENTYL-1H-1,2,4-TRIAZOL-4-IUM-BROMIDE
SpectraBase Compound ID 9NXxybJAVay
InChI InChI=1S/C10H20N3O.BrH/c1-3-4-5-6-12-8-11-13(9-12)7-10(2)14;/h8-10,14H,3-7H2,1-2H3;1H/q+1;/p-1/t10-;/m0./s1
InChIKey QBTJKYMZVFRYFD-PPHPATTJSA-M
Mol Weight 278.194 g/mol
Molecular Formula C10H20BrN3O
Exact Mass 277.078975 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KwEi1NOK685
Name (S)-(+)-1-(2-HYDROXYPROPYL)-4-PENTYL-1H-1,2,4-TRIAZOL-4-IUM-BROMIDE
Compound Number 8D
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C10H20BrN3O
InChI InChI=1S/C10H20N3O.BrH/c1-3-4-5-6-12-8-11-13(9-12)7-10(2)14;/h8-10,14H,3-7H2,1-2H3;1H/q+1;/p-1/t10-;/m0./s1
InChIKey QBTJKYMZVFRYFD-PPHPATTJSA-M
Literature Reference Author P.BOROWIECKI,M.MILNER-KRAWCZYK,J.PLENKIEWICZ
Literature Reference Citation BEIL.J.ORG.CHEM.,9,516(2013)
Literature Reference DOI 10.3762/bjoc.9.56
Molecular Weight 278.192 g/mol
Solvent CDCl3
Source File Reference UWLU77054