For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
4-Amino-6-p-chlorophenyl-3-(2-p-methoxyphenyl-2-oxo-ethylsulfanyl)-4H-[1,2,4]triazin-5-one
SpectraBase Compound ID 3P8NcIrHinj
InChI InChI=1S/C18H15ClN4O3S/c1-26-14-8-4-11(5-9-14)15(24)10-27-18-22-21-16(17(25)23(18)20)12-2-6-13(19)7-3-12/h2-9H,10,20H2,1H3
InChIKey DUKVZAROQWZCCJ-UHFFFAOYSA-N
Mol Weight 402.86 g/mol
Molecular Formula C18H15ClN4O3S
Exact Mass 402.055339 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID CoLjACPbv0e
Name 4-Amino-6-p-chlorophenyl-3-(2-p-methoxyphenyl-2-oxo-ethylsulfanyl)-4H-[1,2,4]triazin-5-one
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H15ClN4O3S
InChI InChI=1S/C18H15ClN4O3S/c1-26-14-8-4-11(5-9-14)15(24)10-27-18-22-21-16(17(25)23(18)20)12-2-6-13(19)7-3-12/h2-9H,10,20H2,1H3
InChIKey DUKVZAROQWZCCJ-UHFFFAOYSA-N
Molecular Weight 402.856 g/mol
SMILES NN1C(C(c2ccc(cc2)Cl)=NN=C1SCC(c1ccc(cc1)OC)=O)=O
SPLASH splash10-0udi-0000900000-80ae17ab62a2f6c8eb46
Source of Spectrum F-67-6272-23o
Wiley ID 1687545