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Metoclopramide-M (Desethyl)
SpectraBase Compound ID EeWZ5Dv4Oft
InChI InChI=1S/C12H18ClN3O2/c1-3-15-4-5-16-12(17)8-6-9(13)10(14)7-11(8)18-2/h6-7,15H,3-5,14H2,1-2H3,(H,16,17)
InChIKey RTQMQUZXBADBGJ-UHFFFAOYSA-N
Mol Weight 271.75 g/mol
Molecular Formula C12H18ClN3O2
Exact Mass 271.108755 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 90wwHxujMTv
Name Metoclopramide-M (deethyl-)
Classification Antiemetic
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Exact Mass 271.108754530 u
Formula C12H18ClN3O2
InChI InChI=1S/C12H18ClN3O2/c1-3-15-4-5-16-12(17)8-6-9(13)10(14)7-11(8)18-2/h6-7,15H,3-5,14H2,1-2H3,(H,16,17)
InChIKey RTQMQUZXBADBGJ-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 271.748 g/mol
SMILES c1c(c(OC)cc(c1Cl)N)C(NCCNCC)=O
SPLASH splash10-0a4i-9100000000-6e4a43cbfbfecf6dbe64
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: UHY
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_1127