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quinolin-8-yl 1-octanesulfonate
SpectraBase Compound ID 4JuwuzzFbci
InChI InChI=1S/C17H23NO3S/c1-2-3-4-5-6-7-14-22(19,20)21-16-12-8-10-15-11-9-13-18-17(15)16/h8-13H,2-7,14H2,1H3
InChIKey UQGBIUXGOIJIFK-UHFFFAOYSA-N
Mol Weight 321.44 g/mol
Molecular Formula C17H23NO3S
Exact Mass 321.139865 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IJZtOSvb4nD
Name quinolin-8-yl 1-octanesulfonate
Appearance White solid
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 321.139864776 u
Formula C17H23NO3S
InChI InChI=1S/C17H23NO3S/c1-2-3-4-5-6-7-14-22(19,20)21-16-12-8-10-15-11-9-13-18-17(15)16/h8-13H,2-7,14H2,1H3
InChIKey UQGBIUXGOIJIFK-UHFFFAOYSA-N
Ionization Type EI
Literature Reference DOI 10.1002/ejoc.201701766
Molecular Weight 321.435 g/mol
Quality 59
SMILES C(CCCCS(OC1=C2C(=CC=C1)C=CC=N2)(=O)=O)CCC
SPLASH splash10-0002-0900000000-5cb3c8a1df818d1f048f
Source of Spectrum K1-2018-SM10-3h (DOI: 10.1002/ejoc.201701766)
Wiley ID 1894022