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3C-E HFB
SpectraBase Compound ID 5tYorb65Grv
InChI InChI=1S/C17H20F7NO4/c1-5-29-13-11(27-3)7-10(8-12(13)28-4)6-9(2)25-14(26)15(18,19)16(20,21)17(22,23)24/h7-9H,5-6H2,1-4H3,(H,25,26)
InChIKey MQGFOWVMSXGOCG-UHFFFAOYSA-N
Mol Weight 435.34 g/mol
Molecular Formula C17H20F7NO4
Exact Mass 435.128055 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID I0Y4eIPqBtm
Name 3C-E HFB
Classification Designer drug Stimulant
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Exact Mass 435.128055265 u
Formula C17H20NO4F7
InChI InChI=1S/C17H20F7NO4/c1-5-29-13-11(27-3)7-10(8-12(13)28-4)6-9(2)25-14(26)15(18,19)16(20,21)17(22,23)24/h7-9H,5-6H2,1-4H3,(H,25,26)
InChIKey MQGFOWVMSXGOCG-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 435.339 g/mol
SMILES c1(OC)cc(cc(OC)c1OCC)CC(NC(=O)C(F)(F)C(F)(F)C(F)(F)F)C
SPLASH splash10-014l-2910100000-1f1dacc1364af09b97ed
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_10933