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1-(4-Cyanomethyl-phenoxy)-3-isopropylammonio-2-propanol cation

View entire compound with spectra: 1 NMR

1-(4-Cyanomethyl-phenoxy)-3-isopropylammonio-2-propanol cation
SpectraBase Compound ID HRlwK9e8mgE
InChI InChI=1S/C14H20N2O2/c1-11(2)16-9-13(17)10-18-14-5-3-12(4-6-14)7-8-15/h3-6,11,13,16-17H,7,9-10H2,1-2H3/p+1
InChIKey VGJIPAKCLDHBAL-UHFFFAOYSA-O
Mol Weight 249.33 g/mol
Molecular Formula C14H21N2O2
Exact Mass 249.160303 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8zzELsW21on
Name 1-(4-Cyanomethyl-phenoxy)-3-isopropylammonio-2-propanol cation
CAS Registry Number 29277-73-4#
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C14H21N2O2
InChI InChI=1S/C14H20N2O2/c1-11(2)16-9-13(17)10-18-14-5-3-12(4-6-14)7-8-15/h3-6,11,13,16-17H,7,9-10H2,1-2H3/p+1
InChIKey VGJIPAKCLDHBAL-UHFFFAOYSA-O
Instrument Name Nicolet QE-300
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent DMSO-D6