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3-furanmethanaminium, 5-carboxy-2-(1,1-dimethylethyl)-N,N-diethyl-, chloride

View entire compound with spectra: 2 NMR, and 1 MS (GC)

3-furanmethanaminium, 5-carboxy-2-(1,1-dimethylethyl)-N,N-diethyl-, chloride
SpectraBase Compound ID 2yakZPNcm3I
InChI InChI=1S/C14H23NO3.ClH/c1-6-15(7-2)9-10-8-11(13(16)17)18-12(10)14(3,4)5;/h8H,6-7,9H2,1-5H3,(H,16,17);1H
InChIKey HMZHQRMJIRZAMM-UHFFFAOYSA-N
Mol Weight 289.8 g/mol
Molecular Formula C14H24ClNO3
Exact Mass 289.144471 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Eh0NpTPRsI9
Name N-[(2-tert-butyl-5-carboxy-3-furyl)methyl]-N-ethylethanaminium chloride
Alternate Name(s) 5-tert-Butyl-4-(diethylaminomethyl)-2-furancarboxylic acid;hydrochloride 5-tert-Butyl-4-(diethylaminomethyl)furan-2-carboxylic acid;hydrochloride
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Formula C14H24ClNO3
InChI InChI=1S/C14H23NO3.ClH/c1-6-15(7-2)9-10-8-11(13(16)17)18-12(10)14(3,4)5;/h8H,6-7,9H2,1-5H3,(H,16,17);1H
InChIKey HMZHQRMJIRZAMM-UHFFFAOYSA-N
Molecular Weight 289.803 g/mol
SMILES [Cl-].OC(c1cc(c(o1)C(C)(C)C)C[NH+](CC)CC)=O
SPLASH splash10-001u-9810000000-3493cb66c57e5cad8c10
Source of Spectrum IY-3-232-0
Wiley ID 1718180