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1H-1,2,4-Triazole-3-carboxylic acid, 1-(2,4-dichlorophenyl)-5-(trichloromethyl)- triethylammonium salt

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1H-1,2,4-Triazole-3-carboxylic acid, 1-(2,4-dichlorophenyl)-5-(trichloromethyl)- triethylammonium salt
SpectraBase Compound ID 60Z5n0e1MH2
InChI InChI=1S/C10H4Cl5N3O2.C6H15N/c11-4-1-2-6(5(12)3-4)18-9(10(13,14)15)16-7(17-18)8(19)20;1-4-7(5-2)6-3/h1-3H,(H,19,20);4-6H2,1-3H3
InChIKey DSNYXPYNGAVAKX-UHFFFAOYSA-N
Mol Weight 476.62 g/mol
Molecular Formula C16H19Cl5N4O2
Exact Mass 473.995064 g/mol

Transmission Infrared (IR) Spectrum

Transmission Infrared (IR) Spectrum

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SpectraBase Spectrum ID IPcWzuRyUcF
Name 1H-1,2,4-Triazole-3-carboxylic acid, 1-(2,4-dichlorophenyl)-5-(trichloromethyl)- triethylammonium salt
CAS Registry Number 103112-36-3
Copyright Copyright © 1989, 1990-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C16H19Cl5N4O2
InChI InChI=1S/C10H4Cl5N3O2.C6H15N/c11-4-1-2-6(5(12)3-4)18-9(10(13,14)15)16-7(17-18)8(19)20;1-4-7(5-2)6-3/h1-3H,(H,19,20);4-6H2,1-3H3
InChIKey DSNYXPYNGAVAKX-UHFFFAOYSA-N
Instrument Name Bruker IFS 85
Purity slightly contaminated
Technique KBr-Pellet