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Nonivamide HFB
SpectraBase Compound ID GG0LcGFvFNr
InChI InChI=1S/C21H26F7NO4/c1-3-4-5-6-7-8-9-17(30)29-13-14-10-11-15(16(12-14)32-2)33-18(31)19(22,23)20(24,25)21(26,27)28/h10-12H,3-9,13H2,1-2H3,(H,29,30)
InChIKey SFJYDIKOHDYWAW-UHFFFAOYSA-N
Mol Weight 489.43 g/mol
Molecular Formula C21H26F7NO4
Exact Mass 489.175005 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IkNf9DL6Mkt
Name Nonivamide HFB
Classification Rubefacient
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Exact Mass 489.175005458 u
Formula C21H26F7NO4
InChI InChI=1S/C21H26F7NO4/c1-3-4-5-6-7-8-9-17(30)29-13-14-10-11-15(16(12-14)32-2)33-18(31)19(22,23)20(24,25)21(26,27)28/h10-12H,3-9,13H2,1-2H3,(H,29,30)
InChIKey SFJYDIKOHDYWAW-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 489.431 g/mol
SMILES C(C(C(Oc1c(cc(cc1)CNC(=O)CCCCCCCC)OC)=O)(F)F)(C(F)(F)F)(F)F
SPLASH splash10-0532-7809100000-51a3488944a623ccc4e8
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_5900