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3-(hydroxymethyl)-4-isopropyl-2-methyl-1-phenyl-3-pyrazolin-5-one
SpectraBase Compound ID 48Osmmf6w2O
InChI InChI=1S/C14H18N2O2/c1-10(2)13-12(9-17)15(3)16(14(13)18)11-7-5-4-6-8-11/h4-8,10,17H,9H2,1-3H3
InChIKey DGXFYROLSAYIBJ-UHFFFAOYSA-N
Mol Weight 246.31 g/mol
Molecular Formula C14H18N2O2
Exact Mass 246.136828 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7LWPPe4BCjf
Name 4-isopropyl-1-methyl-5-methylol-2-phenyl-3-pyrazolin-3-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H18N2O2
InChI InChI=1S/C14H18N2O2/c1-10(2)13-12(9-17)15(3)16(14(13)18)11-7-5-4-6-8-11/h4-8,10,17H,9H2,1-3H3
InChIKey DGXFYROLSAYIBJ-UHFFFAOYSA-N
Molecular Weight 246.310 g/mol
SMILES OCC=1N(C)N(C(C1C(C)C)=O)c1ccccc1
SPLASH splash10-001j-3190000000-0c6bc45fc948155a4ef3
Source of Spectrum CJ-1992-0-0
Synonyms 5-(hydroxymethyl)-1-methyl-2-phenyl-4-propan-2-yl-3-pyrazolone 5-(hydroxymethyl)-1-methyl-2-phenyl-4-propan-2-yl-pyrazol-3-one 5-(hydroxymethyl)-4-isopropyl-1-methyl-2-phenyl-pyrazol-3-one
Wiley ID 1249042