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4-[1-(2'-Methoxyphenyl)propyl]amino-3-mercapto-6-methyl-4H-1,2,4-triazin-5-one
SpectraBase Compound ID 822leqzFbs
InChI InChI=1S/C14H18N4O2S/c1-4-11(10-7-5-6-8-12(10)20-3)17-18-13(19)9(2)15-16-14(18)21/h5-8,11,17H,4H2,1-3H3,(H,16,21)
InChIKey CNJOGEYKANQLSC-UHFFFAOYSA-N
Mol Weight 306.38 g/mol
Molecular Formula C14H18N4O2S
Exact Mass 306.115047 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Ej4GE440Yil
Name 4-[1-(2'-Methoxyphenyl)propyl]amino-3-mercapto-6-methyl-4H-1,2,4-triazin-5-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H18N4O2S
InChI InChI=1S/C14H18N4O2S/c1-4-11(10-7-5-6-8-12(10)20-3)17-18-13(19)9(2)15-16-14(18)21/h5-8,11,17H,4H2,1-3H3,(H,16,21)
InChIKey CNJOGEYKANQLSC-UHFFFAOYSA-N
Molecular Weight 306.384 g/mol
SMILES SC1=NN=C(C(N1NC(c1c(OC)cccc1)CC)=O)C
SPLASH splash10-052e-2920000000-0f902838fd8963e6b7cf
Source of Spectrum QC-17-2622-4
Synonyms 4-{[1-(2-methoxyphenyl)propyl]amino}-6-methyl-3-sulfanyl-1,2,4-triazin-5(4H)-one
Wiley ID 1638546