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

*Links on SpectraBase are not permalinks.
Trichloro-acetic acid, tert-butyl ester
SpectraBase Compound ID BBKNPjUMWJO
InChI InChI=1S/C6H9Cl3O2/c1-5(2,3)11-4(10)6(7,8)9/h1-3H3
InChIKey YROVKSCEXQTHTJ-UHFFFAOYSA-N
Mol Weight 219.49 g/mol
Molecular Formula C6H9Cl3O2
Exact Mass 217.966813 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

View the Full Spectrum for FREE!

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

SpectraBase Spectrum ID GvrYXRbJD0t
Name Trichloro-acetic acid, tert-butyl ester
CAS Registry Number 1860-21-5
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C6H9Cl3O2
InChI InChI=1S/C6H9Cl3O2/c1-5(2,3)11-4(10)6(7,8)9/h1-3H3
InChIKey YROVKSCEXQTHTJ-UHFFFAOYSA-N
Instrument Name Jeol PFT-100
Literature Reference S.W. Pelletier, Z. Djarmati, C.Pape, Tetrahedron 32, 995 (1976).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3