For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
2-(6-Bromohexyloxy)naphthalene-1,4-dione
SpectraBase Compound ID 2N9t7CEnOGN
InChI InChI=1S/C16H17BrO3/c17-9-5-1-2-6-10-20-15-11-14(18)12-7-3-4-8-13(12)16(15)19/h3-4,7-8,11H,1-2,5-6,9-10H2
InChIKey ZBNNMDZHEPFMCC-UHFFFAOYSA-N
Mol Weight 337.21 g/mol
Molecular Formula C16H17BrO3
Exact Mass 336.036107 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 2Y8KmDYxUDL
Name 2-(6-Bromohexyloxy)naphthalene-1,4-dione
Appearance Yellow oil
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H17BrO3
InChI InChI=1S/C16H17BrO3/c17-9-5-1-2-6-10-20-15-11-14(18)12-7-3-4-8-13(12)16(15)19/h3-4,7-8,11H,1-2,5-6,9-10H2
InChIKey ZBNNMDZHEPFMCC-UHFFFAOYSA-N
Ionization Type EI
Literature Reference DOI 10.1021/ml300242v
Molecular Weight 337.213 g/mol
SMILES C(Br)CCCCCOC=1C(c2c(C(C1)=O)cccc2)=O
SPLASH splash10-0a6s-0920000000-14e41c40ba504bd5575d
Source of Spectrum MCS-3-SM5-27e
Thin-Layer Chromatography Rf = 0.60 (hexanes/EtOAc, 5:1)
Wiley ID 1864064