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2-Methyl-8,10-bis(ethoxycarbonyl)di[1,2,3]triazolo[1,5-a:5',1'-d][3,1,5]benzothiadiazepine

View entire compound with spectra: 1 MS (GC)

2-Methyl-8,10-bis(ethoxycarbonyl)di[1,2,3]triazolo[1,5-a:5',1'-d][3,1,5]benzothiadiazepine
SpectraBase Compound ID 3z9jrGTqD2Y
InChI InChI=1S/C17H16N6O4S/c1-4-26-16(24)12-14-22(20-18-12)10-7-6-9(3)8-11(10)23-15(28-14)13(19-21-23)17(25)27-5-2/h6-8H,4-5H2,1-3H3
InChIKey UVTNDRDNUXWRKU-UHFFFAOYSA-N
Mol Weight 400.41 g/mol
Molecular Formula C17H16N6O4S
Exact Mass 400.095374 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LEB3eMsGfdh
Name 2-Methyl-8,10-bis(ethoxycarbonyl)di[1,2,3]triazolo[1,5-a:5',1'-d][3,1,5]benzothiadiazepine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H16N6O4S
InChI InChI=1S/C17H16N6O4S/c1-4-26-16(24)12-14-22(20-18-12)10-7-6-9(3)8-11(10)23-15(28-14)13(19-21-23)17(25)27-5-2/h6-8H,4-5H2,1-3H3
InChIKey UVTNDRDNUXWRKU-UHFFFAOYSA-N
Molecular Weight 400.413 g/mol
SMILES c12[n](-c3c(-[n]4c(S2)c(nn4)C(=O)OCC)cc(cc3)C)nnc1C(=O)OCC
SPLASH splash10-0ufr-4190000000-a2b29e254f2c2aa946b0
Source of Spectrum K-2002-1579-6
Synonyms Diethyl 2-methyldi[1,2,3]triazolo[1,5-a:5,1-d][3,1,5]benzothiadiazepine-8,10-dicarboxylate
Wiley ID 1612802