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1,1-dimethyl-1-propanol, 3,5-dinitrobenzoate
SpectraBase Compound ID AuAcd9xwVVn
InChI InChI=1S/C12H14N2O6/c1-4-12(2,3)20-11(15)8-5-9(13(16)17)7-10(6-8)14(18)19/h5-7H,4H2,1-3H3
InChIKey SZTNJZUWIQIQSW-UHFFFAOYSA-N
Mol Weight 282.25 g/mol
Molecular Formula C12H14N2O6
Exact Mass 282.085186 g/mol

1H Nuclear Magnetic Resonance (NMR) Chemical Shifts

1H Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Lxnf0HN3BjL
Name 1,1-dimethyl-1-propanol, 3,5-dinitrobenzoate
Source of Sample A. V. Camp, Eli Lilly & Company, Indianapolis, Indiana
Copyright Copyright © 2009-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H14N2O6
InChI InChI=1S/C12H14N2O6/c1-4-12(2,3)20-11(15)8-5-9(13(16)17)7-10(6-8)14(18)19/h5-7H,4H2,1-3H3
InChIKey SZTNJZUWIQIQSW-UHFFFAOYSA-N
Instrument Name Varian A-60
Sadtler NMR Number 6426M
Solvent CDCl3
Synonyms BENZOIC ACID, 3,5-DINITRO-, TERT- PENTYL ESTER