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Ethyl 2,2-diphenyl-3-(trichloromethyl)-.delta>(3)-1,3,4-triazoline-1-carboxylate
SpectraBase Compound ID CrsRdHaM1Vj
InChI InChI=1S/C18H16Cl3N3O2/c1-2-26-16(25)23-13-22-24(18(19,20)21)17(23,14-9-5-3-6-10-14)15-11-7-4-8-12-15/h3-13H,2H2,1H3
InChIKey KFUTYEJRZFGVNS-UHFFFAOYSA-N
Mol Weight 412.7 g/mol
Molecular Formula C18H16Cl3N3O2
Exact Mass 411.03081 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6ZVto4i92Hr
Name Ethyl 2,2-diphenyl-3-(trichloromethyl)-.delta>(3)-1,3,4-triazoline-1-carboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H16Cl3N3O2
InChI InChI=1S/C18H16Cl3N3O2/c1-2-26-16(25)23-13-22-24(18(19,20)21)17(23,14-9-5-3-6-10-14)15-11-7-4-8-12-15/h3-13H,2H2,1H3
InChIKey KFUTYEJRZFGVNS-UHFFFAOYSA-N
Molecular Weight 412.704 g/mol
SMILES C1(N(N=CN1C(=O)OCC)C(Cl)(Cl)Cl)(c1ccccc1)c1ccccc1
SPLASH splash10-0f6t-0009100000-1f1da257a67c99aac30e
Source of Spectrum U1-1999-1544-6
Synonyms Ethyl 5,5-diphenyl-1-(trichloromethyl)-1,5-dihydro-4H-1,2,4-triazole-4-carboxylate
Wiley ID 753180