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Methyl 5-(2-(3-(methoxycarbonyl)-1-p-tolyl-1H-1,2,4-triazol-5-yl)-2-p-tolylhydrazinyl)-6-oxo-1-p-tolyl-1,6-dihydro-1,2,4-triazine-3-carboxylate

View entire compound with spectra: 1 MS (GC)

Methyl 5-(2-(3-(methoxycarbonyl)-1-p-tolyl-1H-1,2,4-triazol-5-yl)-2-p-tolylhydrazinyl)-6-oxo-1-p-tolyl-1,6-dihydro-1,2,4-triazine-3-carboxylate
SpectraBase Compound ID CdBfxzLqPPP
InChI InChI=1S/C30H28N8O5/c1-18-6-12-21(13-7-18)36-27(39)24(31-25(34-36)28(40)42-4)33-37(22-14-8-19(2)9-15-22)30-32-26(29(41)43-5)35-38(30)23-16-10-20(3)11-17-23/h6-17H,1-5H3,(H,31,33,34)
InChIKey BFZISCKQRIEULK-UHFFFAOYSA-N
Mol Weight 580.61 g/mol
Molecular Formula C30H28N8O5
Exact Mass 580.218266 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Hct6yV3F5b0
Name Methyl 5-(2-(3-(methoxycarbonyl)-1-p-tolyl-1H-1,2,4-triazol-5-yl)-2-p-tolylhydrazinyl)-6-oxo-1-p-tolyl-1,6-dihydro-1,2,4-triazine-3-carboxylate
Alternate Name(s) Methyl 5-(2-(3-(methoxycarbonyl)-1-(p-tolyl)-1H-1,2,4-triazol-5-yl)-2-(p-tolyl)hydrazineyl)-6-oxo-1-(p-tolyl)-1,6-dihydro-1,2,4-triazine-3-carboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C30H28N8O5
InChI InChI=1S/C30H28N8O5/c1-18-6-12-21(13-7-18)36-27(39)24(31-25(34-36)28(40)42-4)33-37(22-14-8-19(2)9-15-22)30-32-26(29(41)43-5)35-38(30)23-16-10-20(3)11-17-23/h6-17H,1-5H3,(H,31,33,34)
InChIKey BFZISCKQRIEULK-UHFFFAOYSA-N
Literature Reference DOI 10.1002/ajoc.201700271
Molecular Weight 580.605 g/mol
SMILES N(N(c1[n](nc(n1)C(=O)OC)-c1ccc(cc1)C)c1ccc(cc1)C)C1=NC(=NN(C1=O)c1ccc(cc1)C)C(=O)OC
SPLASH splash10-05ai-6865090000-15561e10154b71b66121
Source of Spectrum AJO-6-1475-3j
Wiley ID 1807932