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4-HO-DALT isomer-2 HFB
SpectraBase Compound ID 13liqqyzO6p
InChI InChI=1S/C20H19F7N2O2/c1-3-9-29(10-4-2)11-8-13-12-28-14-6-5-7-15(16(13)14)31-17(30)18(21,22)19(23,24)20(25,26)27/h3-7,12,28H,1-2,8-11H2
InChIKey QYSIWNQYCDQONB-UHFFFAOYSA-N
Mol Weight 452.37 g/mol
Molecular Formula C20H19F7N2O2
Exact Mass 452.133475 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1qpsImo1Y8p
Name 4-HO-DALT isomer-2 HFB
Classification Designer drug
Comments Structure comment: Wiggly bond = unknown position of substituent
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Exact Mass 452.133474999 u
Formula C20H19N2O2F7
InChI InChI=1S/C20H19F7N2O2/c1-3-9-29(10-4-2)11-8-13-12-28-14-6-5-7-15(16(13)14)31-17(30)18(21,22)19(23,24)20(25,26)27/h3-7,12,28H,1-2,8-11H2
InChIKey QYSIWNQYCDQONB-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 452.373 g/mol
SMILES c1ccc2[nH]cc(c2c1OC(=O)C(F)(F)C(F)(F)C(F)(F)F)CCN(CC=C)CC=C
SPLASH splash10-03di-3901000000-8aefcf522adde8a80b92
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
Synonyms 4-Hydroxy-N,N-diallyl-tryptamine isomer-2 HFB
Technique GC/MS
Wiley ID MMPW6e_9404