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Alizapride AC
SpectraBase Compound ID IepiPnkgUbw
InChI InChI=1S/C18H23N5O3/c1-4-7-22-8-5-6-13(22)11-19-18(25)14-9-15-16(10-17(14)26-3)23(12(2)24)21-20-15/h4,9-10,13H,1,5-8,11H2,2-3H3,(H,19,25)
InChIKey PWDHXWLBQKXXRL-UHFFFAOYSA-N
Mol Weight 357.41 g/mol
Molecular Formula C18H23N5O3
Exact Mass 357.18009 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 10GPxrOTbc
Name Alizapride AC
Classification Antiemetic
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Exact Mass 357.180089618 u
Formula C18H23N5O3
InChI InChI=1S/C18H23N5O3/c1-4-7-22-8-5-6-13(22)11-19-18(25)14-9-15-16(10-17(14)26-3)23(12(2)24)21-20-15/h4,9-10,13H,1,5-8,11H2,2-3H3,(H,19,25)
InChIKey PWDHXWLBQKXXRL-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 357.414 g/mol
SMILES C1CN(C(C1)CNC(=O)c1c(cc2c(c1)nn[n]2C(C)=O)OC)CC=C
SPLASH splash10-03di-4900000000-391c759ba5d30094a4b9
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.
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_7817