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Tizanidine 2AC
SpectraBase Compound ID LF9mFhM8J8T
InChI InChI=1S/C13H12ClN5O2S/c1-7(20)18-6-5-15-13(18)19(8(2)21)12-9(14)3-4-10-11(12)17-22-16-10/h3-4H,5-6H2,1-2H3
InChIKey NSOGPUFXNIGTCH-UHFFFAOYSA-N
Mol Weight 337.79 g/mol
Molecular Formula C13H12ClN5O2S
Exact Mass 337.040024 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID RmXeHAM55t
Name Tizanidine 2AC
Classification Muscle relaxant
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Exact Mass 337.040023518 u
Formula C13H12ClN5O2S
InChI InChI=1S/C13H12ClN5O2S/c1-7(20)18-6-5-15-13(18)19(8(2)21)12-9(14)3-4-10-11(12)17-22-16-10/h3-4H,5-6H2,1-2H3
InChIKey NSOGPUFXNIGTCH-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 337.785 g/mol
SMILES CC(N(c1c(ccc2c1nsn2)Cl)C1=NCCN1C(=O)C)=O
SPLASH splash10-02dr-3891000000-0d65d0263c61e07dfddc
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_7252