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3-(2-CHLOROETHYL)-1,2,3-BENZOTRIAZIN-4-ONE

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3-(2-CHLOROETHYL)-1,2,3-BENZOTRIAZIN-4-ONE
SpectraBase Compound ID 6rbBYHmiBIB
InChI InChI=1S/C9H8ClN3O/c10-5-6-13-9(14)7-3-1-2-4-8(7)11-12-13/h1-4H,5-6H2
InChIKey NBHISPQLWAMUIN-UHFFFAOYSA-N
Mol Weight 209.64 g/mol
Molecular Formula C9H8ClN3O
Exact Mass 209.03559 g/mol

15N Nuclear Magnetic Resonance (NMR) Chemical Shifts

15N Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9kxCZQ76cjF
Name 3-(2-CHLOROETHYL)-1,2,3-BENZOTRIAZIN-4-ONE
Compound Number 1D
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C9H8ClN3O
InChI InChI=1S/C9H8ClN3O/c10-5-6-13-9(14)7-3-1-2-4-8(7)11-12-13/h1-4H,5-6H2
InChIKey NBHISPQLWAMUIN-UHFFFAOYSA-N
Literature Reference Author K.VAUGHAN,D.E.V.WILMAN,R.T.WHEELHOUSE,M.F.G.STEVENS
Literature Reference Citation MAGN.RES.CHEM.,40,300(2002)
Literature Reference DOI 10.1002/mrc.994
Solvent DMSO-D6
Source File Reference UWMZ21124