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4-METHYLALLOPHANIC ACID, METHYL ESTER
SpectraBase Compound ID DzInidMlIrd
InChI InChI=1S/C4H8N2O3/c1-5-3(7)6-4(8)9-2/h1-2H3,(H2,5,6,7,8)
InChIKey NTHHMWDGZJHHCY-UHFFFAOYSA-N
Mol Weight 132.12 g/mol
Molecular Formula C4H8N2O3
Exact Mass 132.053492 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JKYXB1SOSaG
Name 4-METHYLALLOPHANIC ACID, METHYL ESTER
Source of Sample R. Rupprecht, W. Bremser BASF Ludwigshafen (1981)
CAS Registry Number 83225-61-0
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C4H8N2O3
InChI InChI=1S/C4H8N2O3/c1-5-3(7)6-4(8)9-2/h1-2H3,(H2,5,6,7,8)
InChIKey NTHHMWDGZJHHCY-UHFFFAOYSA-N
Molecular Weight 132.12
Solvent Chloroform-d; Reference=TMS; Temperature=Ambient Spectrometer= Bruker WM-360
Synonyms ALLOPHANIC ACID, 4-METHYL-, METHYL ESTER