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Aripiprazole-M (N-dealkyl-) AC
SpectraBase Compound ID IHpdbXuyH7z
InChI InChI=1S/C12H14Cl2N2O/c1-9(17)15-5-7-16(8-6-15)11-4-2-3-10(13)12(11)14/h2-4H,5-8H2,1H3
InChIKey WWLOMEAYTOTMSW-UHFFFAOYSA-N
Mol Weight 273.16 g/mol
Molecular Formula C12H14Cl2N2O
Exact Mass 272.048318 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6ENqVfmrFKh
Name Aripiprazole-M (N-dealkyl-) AC
Classification Neuroleptic
Copyright Copyright © 2023-2024 Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 272.048318478 u
Formula C12H14N2OCl2
InChI InChI=1S/C12H14Cl2N2O/c1-9(17)15-5-7-16(8-6-15)11-4-2-3-10(13)12(11)14/h2-4H,5-8H2,1H3
InChIKey WWLOMEAYTOTMSW-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 273.163 g/mol
SMILES c1(c(c(N2CCN(CC2)C(C)=O)ccc1)Cl)Cl
SPLASH splash10-0udi-3980000000-45b3bf96baf8917460b8
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_7123