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Tetrabenazine-M (O-demethyl-HO-)
SpectraBase Compound ID Ag7r0unY8IB
InChI InChI=1S/C18H25NO4/c1-11(10-20)5-13-9-19-4-3-12-6-18(23-2)17(22)7-14(12)15(19)8-16(13)21/h6-7,11,13,15,20,22H,3-5,8-10H2,1-2H3
InChIKey ALMDTPRROBZWOO-UHFFFAOYSA-N
Mol Weight 319.4 g/mol
Molecular Formula C18H25NO4
Exact Mass 319.178358 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HewZJw6iEyF
Name Tetrabenazine-M (O-demethyl-HO-)
Classification Neuroleptic
Copyright Copyright © 2023-2024 Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 319.178358285 u
Formula C18H25NO4
InChI InChI=1S/C18H25NO4/c1-11(10-20)5-13-9-19-4-3-12-6-18(23-2)17(22)7-14(12)15(19)8-16(13)21/h6-7,11,13,15,20,22H,3-5,8-10H2,1-2H3
InChIKey ALMDTPRROBZWOO-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 319.401 g/mol
SMILES C12N(CC(C(C2)=O)CC(CO)C)CCc2cc(c(cc12)O)OC
SPLASH splash10-05mo-0693000000-5b23ff7466c05b7a40b7
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 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_615