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Cytisine TFA
SpectraBase Compound ID DiAKhjONGpo
InChI InChI=1S/C13H13F3N2O2/c14-13(15,16)12(20)17-5-8-4-9(7-17)10-2-1-3-11(19)18(10)6-8/h1-3,8-9H,4-7H2
InChIKey MRQWFYYDOMHTFZ-UHFFFAOYSA-N
Mol Weight 286.25 g/mol
Molecular Formula C13H13F3N2O2
Exact Mass 286.092912 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2L0TM7W8C8
Name Cytisine TFA
Classification Ingredient of laburnum anagyr.
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Exact Mass 286.092912154 u
Formula C13H13N2O2F3
InChI InChI=1S/C13H13F3N2O2/c14-13(15,16)12(20)17-5-8-4-9(7-17)10-2-1-3-11(19)18(10)6-8/h1-3,8-9H,4-7H2
InChIKey MRQWFYYDOMHTFZ-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 286.254 g/mol
SMILES C=1C=C2N(C(C1)=O)CC1CN(CC2C1)C(=O)C(F)(F)F
SPLASH splash10-00kb-5910000000-e739c00ace42cb938f27
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_7443