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5-APBT ethanal adduct
SpectraBase Compound ID JanVW3timsT
InChI InChI=1S/C13H15NS/c1-3-14-10(2)8-11-4-5-13-12(9-11)6-7-15-13/h3-7,9-10H,8H2,1-2H3/b14-3+
InChIKey LGNOEOLRNWLMAS-LZWSPWQCSA-N
Mol Weight 217.33 g/mol
Molecular Formula C13H15NS
Exact Mass 217.092521 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5WzMdJjHEH1
Name 5-APBT ethanal adduct
Classification Designer drug
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Exact Mass 217.092520661 u
Formula C13H15NS
InChI InChI=1S/C13H15NS/c1-3-14-10(2)8-11-4-5-13-12(9-11)6-7-15-13/h3-7,9-10H,8H2,1-2H3/b14-3+
InChIKey LGNOEOLRNWLMAS-LZWSPWQCSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 217.330 g/mol
SMILES c1cc(cc2ccsc12)CC(\N=C\C)C
SPLASH splash10-00di-9300000000-aa4da2f3f809b2d30eca
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
Synonyms 5-(2-Aminopropyl)-1-benzothiophene ethanal adduct
Technique GC/MS
Wiley ID MMPW6e_10875