SpectraBase Spectrum ID |
2lYiAAItWmu |
Name |
Metoclopramide |
CAS Registry Number |
364-62-5 |
Classification |
Pharmaceutical drug, antiemetic |
Comments |
Spectrum verified by crosschecking against external libraries (four reference spectrum with similarity >= 99% found); Spectrum verified by independent measurements in external laboratories |
Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
Exact Mass |
299.140054658 u |
Formula |
C14H22ClN3O2 |
InChI |
InChI=1S/C14H22ClN3O2/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) |
InChIKey |
TTWJBBZEZQICBI-UHFFFAOYSA-N |
Ionization Type |
Electron Ionization (EI) |
Molecular Weight |
299.802 g/mol |
Nominal Mass |
299 u |
Quality |
984 |
Retention Index |
2616 |
SMILES |
NC1=C(C=C(C(=C1)OC)C(NCCN(CC)CC)=O)Cl |
SPLASH |
splash10-000i-9100000000-edaddfc40c5d2fa0e572 |
Source of Spectrum |
DigiLab GmbH (C) 2024 |
Synonyms |
Emequell
Gastrobid Continus
Gastronerton
Hyrin,Imperan
Paspertin
4-Amino-5-chloro-N-(2-diethylaminoethyl)-2-methoxy-benzamide |
Technique |
GC/MS |
Wiley ID |
DD2024_002445 |