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Metoclopramide HCl monohydrate

View entire compound with spectra: 1 FTIR, and 1 Raman

Metoclopramide HCl monohydrate
SpectraBase Compound ID 6BmzgLYap6x
InChI InChI=1S/C14H22ClN3O2.ClH.H2O/c1-4-18(5-2)7-6-17-14(19)10-8-11(15)12(16)9-13(10)20-3;;/h8-9H,4-7,16H2,1-3H3,(H,17,19);1H;1H2
InChIKey KJBLQGHJOCAOJP-UHFFFAOYSA-N
Mol Weight 354.28 g/mol
Molecular Formula C14H25Cl2N3O3
Exact Mass 353.127297 g/mol

Attenuated Total Reflectance Infrared (ATR-IR) Spectrum

Attenuated Total Reflectance Infrared (ATR-IR) Spectrum

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SpectraBase Spectrum ID 3f28kuNVeW6
Name Metoclopramide HCl monohydrate
Source of Sample Alltech Associates, Inc., Grace Davison Discovery Sciences
Catalog Number 01600
Lot Number 427
Accessory DurasamplIR II
CAS Registry Number 54143-57-6
Classification Antiemetic and gastroprokinetic agent
Copyright Copyright © 2009-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H25Cl2N3O3
InChI InChI=1S/C14H22ClN3O2.ClH.H2O/c1-4-18(5-2)7-6-17-14(19)10-8-11(15)12(16)9-13(10)20-3;;/h8-9H,4-7,16H2,1-3H3,(H,17,19);1H;1H2
InChIKey KJBLQGHJOCAOJP-UHFFFAOYSA-N
Instrument Name Bio-Rad FTS
Source of Spectrum Forensic Spectral Research
Synonyms REGLAN 4-Amino-5-chloro-N-(2-(diethylamino)ethyl)-2-methoxybenzamide monohydrochloride
Technique ATR-Neat (DuraSamplIR II)