3-(ALLYLCARBAMOYL)-1-[(DECYLCARBAMOYL)METHYL]PYRIDINIUM CHLORIDE

SpectraBase Compound ID	HWd6Q7WXL2I
InChI	InChI=1S/C21H33N3O2.ClH/c1-3-5-6-7-8-9-10-11-15-22-20(25)18-24-16-12-13-19(17-24)21(26)23-14-4-2;/h4,12-13,16-17H,2-3,5-11,14-15,18H2,1H3,(H-,22,23,25,26);1H
InChIKey	UTVMELDQRFOELW-UHFFFAOYSA-N Google Search
Mol Weight	396.0 g/mol
Molecular Formula	C21H34ClN3O2
Exact Mass	395.233955 g/mol

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SpectraBase Spectrum ID	BcKZEqhJxCz
Name	3-[(allylamino)carbonyl]-1-[2-(decylamino)-2-oxoethyl]pyridinium chloride
Author	A.V.Yarkov, IPAC, Russia
Copyright	Copyright © 2016-2025 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2025 John Wiley & Sons, Inc. All Rights Reserved.
InChI	InChI=1S/C21H33N3O2.ClH/c1-3-5-6-7-8-9-10-11-15-22-20(25)18-24-16-12-13-19(17-24)21(26)23-14-4-2;/h4,12-13,16-17H,2-3,5-11,14-15,18H2,1H3,(H-,22,23,25,26);1H
InChIKey	UTVMELDQRFOELW-UHFFFAOYSA-N
NMR Offset	15.449
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_UBI-VK_18310_14870
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: 987/00000860; Labnumber: 987/00000860218809; VK_ID: VK-014875
Temperature	308 °C