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4,4-Dimethyl-1,2-bis(1,2,4-triazolyl-1)-1-(2,4-dichloro-phenyl)-3-pentanone

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4,4-Dimethyl-1,2-bis(1,2,4-triazolyl-1)-1-(2,4-dichloro-phenyl)-3-pentanone
SpectraBase Compound ID Bw5X359rfLv
InChI InChI=1S/C17H18Cl2N6O/c1-17(2,3)16(26)15(25-10-21-8-23-25)14(24-9-20-7-22-24)12-5-4-11(18)6-13(12)19/h4-10,14-15H,1-3H3
InChIKey HMXFPYGBOSJQNL-UHFFFAOYSA-N
Mol Weight 393.28 g/mol
Molecular Formula C17H18Cl2N6O
Exact Mass 392.091915 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HtRuVzQ700O
Name 4,4-Dimethyl-1,2-bis(1,2,4-triazolyl-1)-1-(2,4-dichloro-phenyl)-3-pentanone
CAS Registry Number 82058-92-2
Comments WHE-8220-03, DIAST.B (45 %)
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C17H18Cl2N6O
InChI InChI=1S/C17H18Cl2N6O/c1-17(2,3)16(26)15(25-10-21-8-23-25)14(24-9-20-7-22-24)12-5-4-11(18)6-13(12)19/h4-10,14-15H,1-3H3
InChIKey HMXFPYGBOSJQNL-UHFFFAOYSA-N
Instrument Name Bruker WM-360
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3