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3-Acetyl-5-(3,4-dihydroxybenzyl)-1-p-tolyl-4,5-dihydro-1H-[1,2,4]triazin-6-one
SpectraBase Compound ID LcBX1miCBsa
InChI InChI=1S/C19H19N3O4/c1-11-3-6-14(7-4-11)22-19(26)15(20-18(21-22)12(2)23)9-13-5-8-16(24)17(25)10-13/h3-8,10,15,24-25H,9H2,1-2H3,(H,20,21)
InChIKey WJKGCIWCPFMLFA-UHFFFAOYSA-N
Mol Weight 353.38 g/mol
Molecular Formula C19H19N3O4
Exact Mass 353.137556 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AV8vaGGkl4G
Name 3-ACETYL-5-(3,4-DIHYDROXYBENZYL)-1-p-TOLYL-4,5-DIHYDRO-1H-[1,2,4]TRIAZIN-6-ONE
Copyright Copyright © 2002-2025 Wiley-VCH GmbH. All Rights Reserved.
Formula C19H19N3O4
InChI InChI=1S/C19H19N3O4/c1-11-3-6-14(7-4-11)22-19(26)15(20-18(21-22)12(2)23)9-13-5-8-16(24)17(25)10-13/h3-8,10,15,24-25H,9H2,1-2H3,(H,20,21)
InChIKey WJKGCIWCPFMLFA-UHFFFAOYSA-N
Molecular Weight 353.1371
SMILES Oc1ccc(CC2C(N(N=C(C(C)=O)N2)c2ccc(C)cc2)=O)cc1O
SPLASH splash10-001i-9861000000-a46a6924be6a2b50ca9c
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany