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XFDQQADEQRAUEK-RMKNXTFCSA-N

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XFDQQADEQRAUEK-RMKNXTFCSA-N
SpectraBase Compound ID 9nHS2T6DfdH
InChI InChI=1S/C8H9NO/c1-9-6-7-4-2-3-5-8(7)10/h2-6,10H,1H3/b9-6+
InChIKey XFDQQADEQRAUEK-RMKNXTFCSA-N
Mol Weight 135.17 g/mol
Molecular Formula C8H9NO
Exact Mass 135.068414 g/mol

17O Nuclear Magnetic Resonance (NMR) Chemical Shifts

17O Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 95OEv0gVBNk
Name XFDQQADEQRAUEK-RMKNXTFCSA-N
Compound Number 2A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C8H9NO
InChI InChI=1S/C8H9NO/c1-9-6-7-4-2-3-5-8(7)10/h2-6,10H,1H3/b9-6+
InChIKey XFDQQADEQRAUEK-RMKNXTFCSA-N
Literature Reference Author J.C.ZHUO
Literature Reference Citation MAGN.RES.CHEM.,37,259(1999)
Literature Reference DOI 10.1002/(sici)1097-458x(199904)37:4<259::aid-mrc442>3.0.co;2-6
Solvent CH3CN
Source File Reference UWSF1447