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1H-1,2,4-Triazole-3-carboxylic acid, 1-(4-chlorophenyl)-5-(trichloromethyl)-, methyl ester
SpectraBase Compound ID G7vkoOVNVDm
InChI InChI=1S/C11H7Cl4N3O2/c1-20-9(19)8-16-10(11(13,14)15)18(17-8)7-4-2-6(12)3-5-7/h2-5H,1H3
InChIKey TWRXJXIONUICML-UHFFFAOYSA-N
Mol Weight 355.0 g/mol
Molecular Formula C11H7Cl4N3O2
Exact Mass 352.929237 g/mol

Transmission Infrared (IR) Spectrum

Transmission Infrared (IR) Spectrum

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SpectraBase Spectrum ID 3LTqp7VH1Bc
Name 1H-1,2,4-Triazole-3-carboxylic acid, 1-(4-chlorophenyl)-5-(trichloromethyl)-, methyl ester
CAS Registry Number 103112-55-6
Copyright Copyright © 1989, 1990-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C11H7Cl4N3O2
InChI InChI=1S/C11H7Cl4N3O2/c1-20-9(19)8-16-10(11(13,14)15)18(17-8)7-4-2-6(12)3-5-7/h2-5H,1H3
InChIKey TWRXJXIONUICML-UHFFFAOYSA-N
Instrument Name Bruker IFS 85
Purity slightly contaminated
Technique KBr-Pellet