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AYTQGTHLGDFDKG-UHFFFAOYSA-N

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AYTQGTHLGDFDKG-UHFFFAOYSA-N
SpectraBase Compound ID 9VU9hDdmuSc
InChI InChI=1S/C15H15NO3/c1-10-8-13(11(2)17)16-14(10)15(18)19-9-12-6-4-3-5-7-12/h3-8,16H,9H2,1-2H3
InChIKey AYTQGTHLGDFDKG-UHFFFAOYSA-N
Mol Weight 257.29 g/mol
Molecular Formula C15H15NO3
Exact Mass 257.105193 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3LTcV4vyxmy
Name 5-ACETYL-3-METHYLPYRROLE-2-CARBOXYLIC ACID, BENZYL ESTER
Source of Sample R. J. Abraham, R. D. Lapper J. Chem. Soc. Perkin Trans. Ii, 1974, 1004
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H15NO3
InChI InChI=1S/C15H15NO3/c1-10-8-13(11(2)17)16-14(10)15(18)19-9-12-6-4-3-5-7-12/h3-8,16H,9H2,1-2H3
InChIKey AYTQGTHLGDFDKG-UHFFFAOYSA-N
Molecular Weight 257.29
Solvent Chloroform-d; Reference=TMS; Temperature=Ambient Spectrometer= Varian XL-100
Synonyms PYRROLE-2-CARBOXYLIC ACID, 5-ACETYL-3-METHYL-, BENZYL ESTER