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Metoclopramide-M (Desethyl) 2AC
SpectraBase Compound ID 4MpZmMopOmw
InChI InChI=1S/C16H22ClN3O4/c1-5-20(11(3)22)7-6-18-16(23)12-8-13(17)14(19-10(2)21)9-15(12)24-4/h8-9H,5-7H2,1-4H3,(H,18,23)(H,19,21)
InChIKey ZXDJANGLQOBTSK-UHFFFAOYSA-N
Mol Weight 355.82 g/mol
Molecular Formula C16H22ClN3O4
Exact Mass 355.129884 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6ozkr4joMfs
Name Metoclopramide-M (deethyl-) 2AC
Classification Antiemetic
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Exact Mass 355.129883896 u
Formula C16H22ClN3O4
InChI InChI=1S/C16H22ClN3O4/c1-5-20(11(3)22)7-6-18-16(23)12-8-13(17)14(19-10(2)21)9-15(12)24-4/h8-9H,5-7H2,1-4H3,(H,18,23)(H,19,21)
InChIKey ZXDJANGLQOBTSK-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 355.822 g/mol
SMILES c1c(C(NCCN(C(=O)C)CC)=O)c(OC)cc(NC(C)=O)c1Cl
SPLASH splash10-0a4i-9630000000-e1995e37678389daa15d
Sample Comments The MMPW Reference Handbook and associated Tables are attached to Record #1, under the Attachments tab. Refer to these references for an explanation of the Sample Preparation Procedure "Detected" abbreviations, as well as other relevant information pertaining to this database.
Sample Preparation Procedure Detected: U+UHYAC
Source of Spectrum H.H.Maurer, M.Meyer, K.Pfleger, A.A. Weber / University of Saarland, D-66424 Homburg Germany
Technique GC/MS
Wiley ID MMPW6e_1897