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3-Acetyl-5-(4-hydroxybenzyl)-1-phenyl-4,5-dihydro-1H-[1,2,4]triazin-6-one
SpectraBase Compound ID 48RCCts6Rmi
InChI InChI=1S/C18H17N3O3/c1-12(22)17-19-16(11-13-7-9-15(23)10-8-13)18(24)21(20-17)14-5-3-2-4-6-14/h2-10,16,23H,11H2,1H3,(H,19,20)
InChIKey IJFGRIAMFMDYDK-UHFFFAOYSA-N
Mol Weight 323.35 g/mol
Molecular Formula C18H17N3O3
Exact Mass 323.126991 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LaDmMfcMEIl
Name 3-ACETYL-5-(4-HYDROXY-BENZYL)-1-PHENYL-4,5-DIHYDRO-1H-[1,2,4]TRIAZIN-6-ONE
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C18H17N3O3
InChI InChI=1S/C18H17N3O3/c1-12(22)17-19-16(11-13-7-9-15(23)10-8-13)18(24)21(20-17)14-5-3-2-4-6-14/h2-10,16,23H,11H2,1H3,(H,19,20)
InChIKey IJFGRIAMFMDYDK-UHFFFAOYSA-N
Molecular Weight 323.1266
SMILES Oc1ccc(CC2C(N(N=C(N2)C(C)=O)c2ccccc2)=O)cc1
SPLASH splash10-066u-9630000000-a4a60001b12c3cb09aea
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany