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2,3,6-Trimethoxy-phenethylamine cation

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2,3,6-Trimethoxy-phenethylamine cation
SpectraBase Compound ID EFh3AuQgGKr
InChI InChI=1S/C11H17NO3/c1-13-9-4-5-10(14-2)11(15-3)8(9)6-7-12/h4-5H,6-7,12H2,1-3H3/p+1
InChIKey SOARXDWNNULVNL-UHFFFAOYSA-O
Mol Weight 212.27 g/mol
Molecular Formula C11H18NO3
Exact Mass 212.128668 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID EXtRiFEs7Pk
Name 2,3,6-Trimethoxy-phenethylamine cation
Comments HYDROCHLORIDE, REASSIGNED (R.R.,W.B.), SHIFTCORRECTION: -1.88 PPM
Copyright Copyright © 2002-2025 Wiley-VCH GmbH. All Rights Reserved.
Formula C11H18NO3
InChI InChI=1S/C11H17NO3/c1-13-9-4-5-10(14-2)11(15-3)8(9)6-7-12/h4-5H,6-7,12H2,1-3H3/p+1
InChIKey SOARXDWNNULVNL-UHFFFAOYSA-O
Instrument Name Bruker WP-80
Literature Reference K. Bailey, D. Legault, Org. Magn. Resonance 21, 391 (1983).
NMR Standard TMS-PRSO3 Na
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent D2O