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3,5-Ditert-butyl-2-nitro-benzoic acid

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

3,5-Ditert-butyl-2-nitro-benzoic acid
SpectraBase Compound ID LsIWSFoXkRE
InChI InChI=1S/C15H21NO4/c1-14(2,3)9-7-10(13(17)18)12(16(19)20)11(8-9)15(4,5)6/h7-8H,1-6H3,(H,17,18)
InChIKey IIOVBZVYKBDMNE-UHFFFAOYSA-N
Mol Weight 279.34 g/mol
Molecular Formula C15H21NO4
Exact Mass 279.147058 g/mol

Transmission Infrared (IR) Spectrum

Transmission Infrared (IR) Spectrum

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SpectraBase Spectrum ID 5dYTaHUNJzo
Name 3,5-DI-tert-BUTYL-2-NITROBENZOIC ACID
Source of Sample A. J. De Koning, the National University of Lesotho, Lesotho, Africa
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H21NO4
InChI InChI=1S/C15H21NO4/c1-14(2,3)9-7-10(13(17)18)12(16(19)20)11(8-9)15(4,5)6/h7-8H,1-6H3,(H,17,18)
InChIKey IIOVBZVYKBDMNE-UHFFFAOYSA-N
Literature Reference REC. TRAV. CHIM.-J. ROY. NETH. CHEM. 95, 160(1976) Abstract-Chemical Abstracts= 85, 108359(1976)
Melting Point 205-207C
Molecular Weight 279.335999
Synonyms BENZOIC ACID, 3,5-DI-TERT-BUTYL- 2-NITRO-,
Technique KBr WAFER