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N-[4-(1-piperidiniumylmethyl)phenyl]-N'-(3,4,5-trimethoxybenzoyl)thiourea chloride
SpectraBase Compound ID DIBxiONcnLs
InChI InChI=1S/C23H29N3O4S.ClH/c1-28-19-13-17(14-20(29-2)21(19)30-3)22(27)25-23(31)24-18-9-7-16(8-10-18)15-26-11-5-4-6-12-26;/h7-10,13-14H,4-6,11-12,15H2,1-3H3,(H2,24,25,27,31);1H
InChIKey JXPMDVYFBRKXJO-UHFFFAOYSA-N
Mol Weight 480.02 g/mol
Molecular Formula C23H30ClN3O4S
Exact Mass 479.164555 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID KdiWOdK89E6
Name N-[4-(1-piperidiniumylmethyl)phenyl]-N'-(3,4,5-trimethoxybenzoyl)thiourea 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/C23H29N3O4S.ClH/c1-28-19-13-17(14-20(29-2)21(19)30-3)22(27)25-23(31)24-18-9-7-16(8-10-18)15-26-11-5-4-6-12-26;/h7-10,13-14H,4-6,11-12,15H2,1-3H3,(H2,24,25,27,31);1H
InChIKey JXPMDVYFBRKXJO-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_18603
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: D32951; Labnumber: SPMOS1-41181; SBI_ID: SBI-018606
Temperature 318 °C