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4-[N-(o-Aminophenyl)acetimidoyl]-5-hydroxy-3-methyl-1-phenylpyrazole
SpectraBase Compound ID CeEjclycvu6
InChI InChI=1S/C18H18N4O/c1-12(20-16-11-7-6-10-15(16)19)17-13(2)21-22(18(17)23)14-8-4-3-5-9-14/h3-11,23H,19H2,1-2H3/b20-12+
InChIKey JVPMUPNGKXTEPT-UDWIEESQSA-N
Mol Weight 306.37 g/mol
Molecular Formula C18H18N4O
Exact Mass 306.148061 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GBKuLqUA6uq
Name 4-[N-(o-Aminophenyl)acetimidoyl]-5-hydroxy-3-methyl-1-phenylpyrazole
Alternate Name(s) 4-[1-(2-Aminophenyl)iminoethyl]-3-methyl-1-phenyl-5-hydroxypyrazole 4-[(1E)-N-(2-aminophenyl)ethanimidoyl]-3-methyl-1-phenyl-1H-pyrazol-5-ol
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H18N4O
InChI InChI=1S/C18H18N4O/c1-12(20-16-11-7-6-10-15(16)19)17-13(2)21-22(18(17)23)14-8-4-3-5-9-14/h3-11,23H,19H2,1-2H3/b20-12+
InChIKey JVPMUPNGKXTEPT-UDWIEESQSA-N
Molecular Weight 306.369 g/mol
SMILES Oc1[n](nc(c1\C(=N\c1c(cccc1)N)C)C)-c1ccccc1
SPLASH splash10-0006-0092000000-12e7f32c883d5fb38b94
Source of Spectrum Y1-42-2823-3
Wiley ID 1565350