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{[(4-CARBOXY-3-HYDROXYPHENYL)CARBAMOYL]METHYL}TRIMETHYLAMMONIUM IODIDE, METHYLESTER
SpectraBase Compound ID KSVRJZuUuB2
InChI InChI=1S/C13H18N2O4.HI/c1-15(2,3)8-12(17)14-9-5-6-10(11(16)7-9)13(18)19-4;/h5-7H,8H2,1-4H3,(H-,14,16,17,18);1H
InChIKey QALLICVLMVNBNX-UHFFFAOYSA-N
Mol Weight 394.21 g/mol
Molecular Formula C13H19IN2O4
Exact Mass 394.038952 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID E1utxxgRjOC
Name {[(4-CARBOXY-3-HYDROXYPHENYL)CARBAMOYL]METHYL}TRIMETHYLAMMONIUM IODIDE, METHYLESTER
Source of Sample G. Tsatsas, University of Athens, Athens, Greece
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H19IN2O4
InChI InChI=1S/C13H18N2O4.HI/c1-15(2,3)8-12(17)14-9-5-6-10(11(16)7-9)13(18)19-4;/h5-7H,8H2,1-4H3,(H-,14,16,17,18);1H
InChIKey QALLICVLMVNBNX-UHFFFAOYSA-N
Melting Point 264C (dec.)
Molecular Weight 394.21
Solvent Polysol; Reference=TMS Spectrometer= Varian CFT-20
Synonyms AMMONIUM IODIDE, ///4-CARBOXY-3- HYDROXYPHENYL/CARBAMOYL/METHYL/TRIMETHYL-, METHYL ESTER