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Ethyl 7-Methyl-5-phenyl-5H-pyrazolo[4,3-f][1,2,3]triazolo[5,1-b][1,3,4]thiadiazepine-3-carboxylate
SpectraBase Compound ID 24aYiaQ1ocl
InChI InChI=1S/C16H14N6O2S/c1-3-24-16(23)13-15-22(20-18-13)17-9-12-10(2)19-21(14(12)25-15)11-7-5-4-6-8-11/h4-9H,3H2,1-2H3
InChIKey LOBCSDNGWVUHID-UHFFFAOYSA-N
Mol Weight 354.39 g/mol
Molecular Formula C16H14N6O2S
Exact Mass 354.089895 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JzcdHMJLIPY
Name Ethyl 7-Methyl-5-phenyl-5H-pyrazolo[4,3-f][1,2,3]triazolo[5,1-b][1,3,4]thiadiazepine-3-carboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H14N6O2S
InChI InChI=1S/C16H14N6O2S/c1-3-24-16(23)13-15-22(20-18-13)17-9-12-10(2)19-21(14(12)25-15)11-7-5-4-6-8-11/h4-9H,3H2,1-2H3
InChIKey LOBCSDNGWVUHID-UHFFFAOYSA-N
Molecular Weight 354.388 g/mol
SMILES c12[n](nnc2C(=O)OCC)N=Cc2c(S1)[n](nc2C)-c1ccccc1
SPLASH splash10-0fb9-7490000000-f9c9e58a4aaee0138ac7
Source of Spectrum HC-49-675-6
Wiley ID 1739643