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Ethanone, 1-(2,4-dichlorophenyl)-2-(2-methoxyethoxy)-2-(1H-1,2,4-triazol-1-yl)-, mononitrate
SpectraBase Compound ID 4G2in7VoMM
InChI InChI=1S/C13H13Cl2N3O3.NO3/c1-20-4-5-21-13(18-8-16-7-17-18)12(19)10-3-2-9(14)6-11(10)15;2-1(3)4/h2-3,6-8,13H,4-5H2,1H3;/q;-1/p+1
InChIKey TUGHGMAQZUIHLO-UHFFFAOYSA-O
Mol Weight 393.183 g/mol
Molecular Formula C13H14Cl2N4O6
Exact Mass 392.02904 g/mol

Transmission Infrared (IR) Spectrum

Transmission Infrared (IR) Spectrum

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SpectraBase Spectrum ID 7m9kfirOsJO
Name Ethanone, 1-(2,4-dichlorophenyl)-2-(2-methoxyethoxy)-2-(1H-1,2,4-triazol-1-yl)-, mononitrate
CAS Registry Number 109895-68-3
Copyright Copyright © 1989, 1990-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C13H14Cl2N4O6
InChI InChI=1S/C13H13Cl2N3O3.NO3/c1-20-4-5-21-13(18-8-16-7-17-18)12(19)10-3-2-9(14)6-11(10)15;2-1(3)4/h2-3,6-8,13H,4-5H2,1H3;/q;-1/p+1
InChIKey TUGHGMAQZUIHLO-UHFFFAOYSA-O
Instrument Name Bruker IFS 85
Technique KBr-Pellet