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

*Links on SpectraBase are not permalinks.

t-Butyl 4-nitrobenzoate

View entire compound with spectra: 2 NMR, and 1 MS (GC)

t-Butyl 4-nitrobenzoate
SpectraBase Compound ID 5CUa8RDPRUo
InChI InChI=1S/C11H13NO4/c1-11(2,3)16-10(13)8-4-6-9(7-5-8)12(14)15/h4-7H,1-3H3
InChIKey ADMFDTHMUXRMJQ-UHFFFAOYSA-N
Mol Weight 223.23 g/mol
Molecular Formula C11H13NO4
Exact Mass 223.084458 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 E0lmp7MB1c9
Name 4-Nitro-benzoic acid, tert-butyl ester
CAS Registry Number 19756-72-0
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C11H13NO4
InChI InChI=1S/C11H13NO4/c1-11(2,3)16-10(13)8-4-6-9(7-5-8)12(14)15/h4-7H,1-3H3
InChIKey ADMFDTHMUXRMJQ-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