1H-indole-3-ethanaminium, N-[(4-carboxyphenyl)methyl]-, chloride

SpectraBase Compound ID	LOEKZ1aPC52
InChI	InChI=1S/C18H18N2O2.ClH/c21-18(22)14-7-5-13(6-8-14)11-19-10-9-15-12-20-17-4-2-1-3-16(15)17;/h1-8,12,19-20H,9-11H2,(H,21,22);1H
InChIKey	HCJGBJNGWMCHRP-UHFFFAOYSA-N Google Search
Mol Weight	330.81 g/mol
Molecular Formula	C18H19ClN2O2
Exact Mass	330.113506 g/mol

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SpectraBase Spectrum ID	3KkDqIn2teu
Name	1H-indole-3-ethanaminium, N-[(4-carboxyphenyl)methyl]-, chloride
Author	A.V.Yarkov, IPAC, Russia
Copyright	Copyright © 2016-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2021 John Wiley & Sons, Inc. All Rights Reserved.
InChI	InChI=1S/C18H18N2O2.ClH/c21-18(22)14-7-5-13(6-8-14)11-19-10-9-15-12-20-17-4-2-1-3-16(15)17;/h1-8,12,19-20H,9-11H2,(H,21,22);1H
InChIKey	HCJGBJNGWMCHRP-UHFFFAOYSA-N
NMR Offset	15.5012
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_SBI_11628_8384
Owner	Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc.
Sample State	soluted
Solvent	DMSO-d6
Source File Reference	VendorID: F32122; Labnumber: SPHRAM1-35706