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Lofexidine AC
SpectraBase Compound ID 7lBqPwTTuoI
InChI InChI=1S/C13H14Cl2N2O2/c1-8(13-16-6-7-17(13)9(2)18)19-12-10(14)4-3-5-11(12)15/h3-5,8H,6-7H2,1-2H3
InChIKey FYCHFYGKJCFQDM-UHFFFAOYSA-N
Mol Weight 301.17 g/mol
Molecular Formula C13H14Cl2N2O2
Exact Mass 300.043233 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AIHFbsdTwMY
Name Lofexidine AC
Classification Antihypertensive
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Exact Mass 300.043233097 u
Formula C13H14Cl2N2O2
InChI InChI=1S/C13H14Cl2N2O2/c1-8(13-16-6-7-17(13)9(2)18)19-12-10(14)4-3-5-11(12)15/h3-5,8H,6-7H2,1-2H3
InChIKey FYCHFYGKJCFQDM-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 301.173 g/mol
Related CAS Registry Number(s) 31036-80-3
SMILES c1ccc(c(OC(C=2N(C(=O)C)CCN2)C)c1Cl)Cl
SPLASH splash10-000i-9330000000-4d2c56637762d5899b26
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_5209