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1-(benzotriazol-1-yl)ethanone

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1-(benzotriazol-1-yl)ethanone
SpectraBase Compound ID JBxOuyqDkdi
InChI InChI=1S/C8H7N3O/c1-6(12)11-8-5-3-2-4-7(8)9-10-11/h2-5H,1H3
InChIKey NIIUIBKEGRPPDK-UHFFFAOYSA-N
Mol Weight 161.16 g/mol
Molecular Formula C8H7N3O
Exact Mass 161.058912 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7PtCdai8wuX
Name 1-Acetyl-benzotriazole
CAS Registry Number 18773-93-8
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C8H7N3O
InChI InChI=1S/C8H7N3O/c1-6(12)11-8-5-3-2-4-7(8)9-10-11/h2-5H,1H3
InChIKey NIIUIBKEGRPPDK-UHFFFAOYSA-N
Instrument Name Bruker WH-90
Literature Reference M. Begtrup, R.M. Claramunt, J. Elguero, J. Chem. Soc. Perkin II 99 (1978).
NMR Standard CDCl3
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3