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2-Bromo-4,5-dimethoxybenzyl alcohol PFP
SpectraBase Compound ID 33Afsc45pZU
InChI InChI=1S/C12H10BrF5O4/c1-20-8-3-6(7(13)4-9(8)21-2)5-22-10(19)11(14,15)12(16,17)18/h3-4H,5H2,1-2H3
InChIKey RKZTXRGBLWXNGM-UHFFFAOYSA-N
Mol Weight 393.1 g/mol
Molecular Formula C12H10BrF5O4
Exact Mass 391.968263 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GKSDp6hODWs
Name 2-Bromo-4,5-dimethoxybenzyl alcohol PFP
Classification Designer drug side product derivative
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 391.968262613 u
Formula C12H10BrF5O4
InChI InChI=1S/C12H10BrF5O4/c1-20-8-3-6(7(13)4-9(8)21-2)5-22-10(19)11(14,15)12(16,17)18/h3-4H,5H2,1-2H3
InChIKey RKZTXRGBLWXNGM-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 393.104 g/mol
Nominal Mass 392 u
Quality 997
Retention Index 1615
SMILES C(C(F)(F)F)(C(OCC=1C(=CC(=C(C1)OC)OC)Br)=O)(F)F
SPLASH splash10-0036-6597000000-3c6a72325ecbc889359f
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms (2-Bromo-4,5-dimethoxyphenyl)methyl pentafluoropropionate 2-bromo-4,5-dimethoxybenzyl 2,2,3,3,3-pentafluoropropanoate
Technique GC/MS
Wiley ID DD2024_009078