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Guanfacine
SpectraBase Compound ID LaSvkzXkYM9
InChI InChI=1S/C9H9Cl2N3O/c10-6-2-1-3-7(11)5(6)4-8(15)14-9(12)13/h1-3H,4H2,(H4,12,13,14,15)
InChIKey INJOMKTZOLKMBF-UHFFFAOYSA-N
Mol Weight 246.1 g/mol
Molecular Formula C9H9Cl2N3O
Exact Mass 245.012267 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8AqVygTnIDa
Name Guanfacine
CAS Registry Number 29110-47-2
Classification Antihypertensive
Copyright Copyright © 2023-2024 Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 245.012267321 u
Formula C9H9N3OCl2
InChI InChI=1S/C9H9Cl2N3O/c10-6-2-1-3-7(11)5(6)4-8(15)14-9(12)13/h1-3H,4H2,(H4,12,13,14,15)
InChIKey INJOMKTZOLKMBF-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 246.097 g/mol
SMILES c1c(c(CC(NC(=N)N)=O)c(cc1)Cl)Cl
SPLASH splash10-0udi-4900000000-45b85a69c63cb9773f4d
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_7561