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Methallylescaline HFB
SpectraBase Compound ID 4iGl3qw5Hu7
InChI InChI=1S/C18H20F7NO4/c1-10(2)9-30-14-12(28-3)7-11(8-13(14)29-4)5-6-26-15(27)16(19,20)17(21,22)18(23,24)25/h7-8H,1,5-6,9H2,2-4H3,(H,26,27)
InChIKey DTAHNZIKKVTSFP-UHFFFAOYSA-N
Mol Weight 447.35 g/mol
Molecular Formula C18H20F7NO4
Exact Mass 447.128055 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 82Ic7j2WN37
Name Methallylescaline HFB
Classification Designer drug Stimulant
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Exact Mass 447.128055265 u
Formula C18H20NO4F7
InChI InChI=1S/C18H20F7NO4/c1-10(2)9-30-14-12(28-3)7-11(8-13(14)29-4)5-6-26-15(27)16(19,20)17(21,22)18(23,24)25/h7-8H,1,5-6,9H2,2-4H3,(H,26,27)
InChIKey DTAHNZIKKVTSFP-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 447.350 g/mol
SMILES c1(cc(CCNC(=O)C(F)(F)C(F)(F)C(F)(F)F)cc(OC)c1OCC(=C)C)OC
SPLASH splash10-004l-3903100000-54204f3c81410c7c30f7
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_10800