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1-Oxyl-3-(tributylammoniumylmethyl)-2,2,5,5-tetramethyl-3-pyrroline Bromide
SpectraBase Compound ID CxPCAm1oWwD
InChI InChI=1S/C21H42N2O.BrH/c1-8-11-14-23(15-12-9-2,16-13-10-3)18-19-17-20(4,5)22(24)21(19,6)7;/h17H,8-16,18H2,1-7H3;1H/q+1;/p-1
InChIKey KOHZADZHKSYHNQ-UHFFFAOYSA-M
Mol Weight 419.5 g/mol
Molecular Formula C21H43BrN2O
Exact Mass 418.255877 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5DKDuWnGC1n
Name 1-Oxyl-3-(tributylammoniumylmethyl)-2,2,5,5-tetramethyl-3-pyrroline Bromide
Alternate Name(s) Tributyl-[(1-$l^{1}-oxidanyl-2,2,5,5-tetramethyl-3-pyrrolyl)methyl]ammonium;bromide Tributyl-[(1-$l^{1}-oxidanyl-2,2,5,5-tetramethylpyrrol-3-yl)methyl]azanium;bromide Tributyl-[(1-$l^{1}-oxidanyl-2,2,5,5-tetramethyl-pyrrol-3-yl)methyl]ammonium;bromide Tributyl-[(1-$l^{1}-oxidanyl-2,2,5,5-tetramethyl-pyrrol-3-yl)methyl]azanium;bromide
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Formula C21H42BrN2O
InChI InChI=1S/C21H42N2O.BrH/c1-8-11-14-23(15-12-9-2,16-13-10-3)18-19-17-20(4,5)22(24)21(19,6)7;/h17H,8-16,18H2,1-7H3;1H/q+1;/p-1
InChIKey KOHZADZHKSYHNQ-UHFFFAOYSA-M
Molecular Weight 419.492 g/mol
SMILES [Br-].ON1C(C(=CC1(C)C)C[N+](CCCC)(CCCC)CCCC)(C)C
SPLASH splash10-0006-0900000000-34910c3b7da443add5ff
Source of Spectrum F2-41-3490-31
Wiley ID 1599753