.pi.5-[3-((Cyclopentadienyl)propyl)-2-acetoxybenzoate]thallium

SpectraBase Compound ID	DbKlmfQkdNW
InChI	InChI=1S/C17H17O4.Tl/c1-13(18)21-16-11-5-4-10-15(16)17(19)20-12-6-9-14-7-2-3-8-14;/h2-5,7-8,10-11H,6,9,12H2,1H3;
InChIKey	PTEOUQLRNMVEFA-UHFFFAOYSA-N Google Search
Mol Weight	489.7 g/mol
Molecular Formula	C17H17O4Tl
Exact Mass	490.087111 g/mol

View the Full Spectrum for FREE!

SpectraBase Spectrum ID	DKJHdR92V4G
Name	.pi.5-[3-((Cyclopentadienyl)propyl)-2-acetoxybenzoate]thallium
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C17H17O4Tl
InChI	InChI=1S/C17H17O4.Tl/c1-13(18)21-16-11-5-4-10-15(16)17(19)20-12-6-9-14-7-2-3-8-14;/h2-5,7-8,10-11H,6,9,12H2,1H3;
InChIKey	PTEOUQLRNMVEFA-UHFFFAOYSA-N
Molecular Weight	489.699 g/mol
SMILES	[C@]12([Tl]345[C@@]2([C@]5([C@]4([C@@]13[H])[H])[H])[H])CCCOC(c1c(OC(=O)C)cccc1)=O
SPLASH	splash10-0ab9-0910000000-dc8decc7a699180dc8da
Source of Spectrum	F2-45-5161-0
Wiley ID	1703720