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8-[(4'-Methoxyphenyl)azo]-2-phenyl-4-thioxo-3,4-dihydropyrazolo[1,5-a]-(1,3,5)-triazin-7(6H)-one
SpectraBase Compound ID 81yHJZR9KRu
InChI InChI=1S/C18H14N6O2S/c1-26-13-9-7-12(8-10-13)21-22-14-16-19-15(11-5-3-2-4-6-11)20-18(27)24(16)23-17(14)25/h2-10H,1H3,(H,23,25)(H,19,20,27)/b22-21+
InChIKey BVQVDFIIOVVDID-QURGRASLSA-N
Mol Weight 378.41 g/mol
Molecular Formula C18H14N6O2S
Exact Mass 378.089895 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JEmQoDvqL9v
Name 8-[(4'-Methoxyphenyl)azo]-2-phenyl-4-thioxo-3,4-dihydropyrazolo[1,5-a]-(1,3,5)-triazin-7(6H)-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H14N6O2S
InChI InChI=1S/C18H14N6O2S/c1-26-13-9-7-12(8-10-13)21-22-14-16-19-15(11-5-3-2-4-6-11)20-18(27)24(16)23-17(14)25/h2-10H,1H3,(H,23,25)(H,19,20,27)/b22-21+
InChIKey BVQVDFIIOVVDID-QURGRASLSA-N
Molecular Weight 378.410 g/mol
SMILES N1C(N2C(=C(C(=O)N2)\N=N\c2ccc(cc2)OC)N=C1c1ccccc1)=S
SPLASH splash10-014i-3912000000-4d12dcb81d173158b4d0
Source of Spectrum AH-139-158-8
Wiley ID 1695990