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TDMA HFB
SpectraBase Compound ID 5JYFNr77TuF
InChI InChI=1S/C14H12F7N3OS/c1-7(5-8-3-4-9-10(6-8)23-26-22-9)24(2)11(25)12(15,16)13(17,18)14(19,20)21/h3-4,6-7H,5H2,1-2H3
InChIKey ITBMSNNUIXZYQY-UHFFFAOYSA-N
Mol Weight 403.32 g/mol
Molecular Formula C14H12F7N3OS
Exact Mass 403.05893 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8g1fxKqho23
Name TDMA HFB
Classification Designer drug
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Exact Mass 403.058930332 u
Formula C14H12N3OF7S
InChI InChI=1S/C14H12F7N3OS/c1-7(5-8-3-4-9-10(6-8)23-26-22-9)24(2)11(25)12(15,16)13(17,18)14(19,20)21/h3-4,6-7H,5H2,1-2H3
InChIKey ITBMSNNUIXZYQY-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 403.319 g/mol
SMILES c1c2nsnc2cc(c1)CC(C)N(C)C(C(F)(F)C(F)(F)C(F)(F)F)=O
SPLASH splash10-0udi-3690000000-d6c91831fca221f4bd3a
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_10921