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2-(5-Bromopentyl)naphthalene-1,4-dione
SpectraBase Compound ID 9EF8nfmzorU
InChI InChI=1S/C15H15BrO2/c16-9-5-1-2-6-11-10-14(17)12-7-3-4-8-13(12)15(11)18/h3-4,7-8,10H,1-2,5-6,9H2
InChIKey NCGNXHDNPQLHKU-UHFFFAOYSA-N
Mol Weight 307.19 g/mol
Molecular Formula C15H15BrO2
Exact Mass 306.025543 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HAiJqDrSJRI
Name 2-(5-Bromopentyl)naphthalene-1,4-dione
Appearance Yellow solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H15BrO2
InChI InChI=1S/C15H15BrO2/c16-9-5-1-2-6-11-10-14(17)12-7-3-4-8-13(12)15(11)18/h3-4,7-8,10H,1-2,5-6,9H2
InChIKey NCGNXHDNPQLHKU-UHFFFAOYSA-N
Ionization Type EI
Literature Reference DOI 10.1021/ml300242v
Molecular Weight 307.187 g/mol
SMILES C(Br)CCCCC=1C(c2c(C(C1)=O)cccc2)=O
SPLASH splash10-006t-0900000000-a76a75b80474ce4376a4
Source of Spectrum MCS-3-SM1-4a
Thin-Layer Chromatography Rf = 0.50 (hexanes/EtOAc, 7:1)
Wiley ID 1864074