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Tizanidine AC
SpectraBase Compound ID GnXTx9v7dWe
InChI InChI=1S/C11H10ClN5OS/c1-6(18)17-5-4-13-11(17)14-9-7(12)2-3-8-10(9)16-19-15-8/h2-3H,4-5H2,1H3,(H,13,14)
InChIKey NBGDKTHDTLEUQJ-UHFFFAOYSA-N
Mol Weight 295.75 g/mol
Molecular Formula C11H10ClN5OS
Exact Mass 295.029459 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 72fFtIm1HH1
Name Tizanidine AC
Classification Muscle relaxant
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Exact Mass 295.029458835 u
Formula C11H10ClN5OS
InChI InChI=1S/C11H10ClN5OS/c1-6(18)17-5-4-13-11(17)14-9-7(12)2-3-8-10(9)16-19-15-8/h2-3H,4-5H2,1H3,(H,13,14)
InChIKey NBGDKTHDTLEUQJ-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 295.748 g/mol
SMILES CC(N1C(Nc2c(Cl)ccc3c2nsn3)=NCC1)=O
SPLASH splash10-00ks-8980000000-377396927418026c6cc8
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_7253