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BA HFB
SpectraBase Compound ID 6YlYKFn3IIs
InChI InChI=1S/C21H20F7NO4/c1-31-15-10-14(8-9-29-18(30)19(22,23)20(24,25)21(26,27)28)11-16(32-2)17(15)33-12-13-6-4-3-5-7-13/h3-7,10-11H,8-9,12H2,1-2H3,(H,29,30)
InChIKey PPUZHSHPGKELCJ-UHFFFAOYSA-N
Mol Weight 483.38 g/mol
Molecular Formula C21H20F7NO4
Exact Mass 483.128055 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2eJ7xg64yO
Name BA HFB
Classification Phenethylamine designer drug derivative
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 483.128055265 u
Formula C21H20F7NO4
InChI InChI=1S/C21H20F7NO4/c1-31-15-10-14(8-9-29-18(30)19(22,23)20(24,25)21(26,27)28)11-16(32-2)17(15)33-12-13-6-4-3-5-7-13/h3-7,10-11H,8-9,12H2,1-2H3,(H,29,30)
InChIKey PPUZHSHPGKELCJ-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 483.383 g/mol
Nominal Mass 483 u
Quality 994
Retention Index 2421
SMILES C(C(C(F)(F)F)(F)F)(C(NCCC1=CC(=C(C(=C1)OC)OCC=1C=CC=CC1)OC)=O)(F)F
SPLASH splash10-002f-7900000000-ac601f69c7f0c2c540b9
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms N-Heptafluorobutyryl-4-benzyloxy-3,5-dimethoxyphenethylamine N-(2-(4-(benzyloxy)-3,5-dimethoxyphenyl)ethyl)-2,2,3,3,4,4,4-heptafluorobutanamide
Technique GC/MS
Wiley ID DD2024_016402