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p-(1-methyl-1-nitroethyl)benzoic acid, methyl ester
SpectraBase Compound ID BaPYL4wb3Y6
InChI InChI=1S/C11H13NO4/c1-11(2,12(14)15)9-6-4-8(5-7-9)10(13)16-3/h4-7H,1-3H3
InChIKey HAUXVYHNWVRHOF-UHFFFAOYSA-N
Mol Weight 223.23 g/mol
Molecular Formula C11H13NO4
Exact Mass 223.084458 g/mol

13C Nuclear Magnetic Resonance (NMR) Spectrum

13C Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 97jEr9tAT6i
Name p-(1-METHYL-1-NITROETHYL)BENZOIC ACID, METHYL ESTER
Source of Sample N. Kornblum, Purdue University, West Lafayette, Indiana
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H13NO4
InChI InChI=1S/C11H13NO4/c1-11(2,12(14)15)9-6-4-8(5-7-9)10(13)16-3/h4-7H,1-3H3
InChIKey HAUXVYHNWVRHOF-UHFFFAOYSA-N
Melting Point 50-51.5C
Molecular Weight 223.23
Solvent Chloroform-d; Reference=TMS Spectrometer= Varian CFT-20
Synonyms BENZOIC ACID, P-/1-METHYL-1-NITRO- ETHYL/-, METHYL ESTER