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alpha-Bromo-heptanophenone
SpectraBase Compound ID 36RtTakLap0
InChI InChI=1S/C13H17BrO/c1-2-3-5-10-12(14)13(15)11-8-6-4-7-9-11/h4,6-9,12H,2-3,5,10H2,1H3
InChIKey SLTFKUDVTFWTKW-UHFFFAOYSA-N
Mol Weight 269.18 g/mol
Molecular Formula C13H17BrO
Exact Mass 268.046278 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8HTCqWWU8zA
Name alpha-Bromo-heptanophenone
Classification Designer drug precursor
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 268.046278166 u
Formula C13H17BrO
InChI InChI=1S/C13H17BrO/c1-2-3-5-10-12(14)13(15)11-8-6-4-7-9-11/h4,6-9,12H,2-3,5,10H2,1H3
InChIKey SLTFKUDVTFWTKW-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 269.182 g/mol
Nominal Mass 268 u
Quality 954
Retention Index 1769
SMILES C(C1=CC=CC=C1)(C(CCCCC)Br)=O
SPLASH splash10-0a4i-4900000000-343be1c675a0a6f0501b
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms 2-Bromo-1-phenylheptan-1-one
Technique GC/MS
Wiley ID DD2024_000312