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4-CARBOXYBENZOXAZOLIN-2-ONE

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4-CARBOXYBENZOXAZOLIN-2-ONE
SpectraBase Compound ID Ec7b0MHZ7P0
InChI InChI=1S/C8H5NO4/c10-7(11)4-2-1-3-5-6(4)9-8(12)13-5/h1-3H,(H,9,12)(H,10,11)
InChIKey BHUOYWFKNMUNNR-UHFFFAOYSA-N
Mol Weight 179.13 g/mol
Molecular Formula C8H5NO4
Exact Mass 179.021858 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 58pljbLxcOO
Name 4-CARBOXYBENZOXAZOLIN-2-ONE
Compound Number 4
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C8H5NO4
InChI InChI=1S/C8H5NO4/c10-7(11)4-2-1-3-5-6(4)9-8(12)13-5/h1-3H,(H,9,12)(H,10,11)
InChIKey BHUOYWFKNMUNNR-UHFFFAOYSA-N
Literature Reference Author D.A.FIELDER,F.W.COLLINS
Literature Reference Citation J.NAT.PROD.,58,456(1995)
Literature Reference DOI 10.1021/np50117a019
Molecular Weight 179.132 g/mol
Solvent CD3OD
Source File Reference UWMR9