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1-(p-acetoxyphenyl)-2-methyl-3-hydroxymethyl-4-(prop-2-yl)-2,5-dihydropyrazole-5-one
SpectraBase Compound ID HIwf2i6bR0d
InChI InChI=1S/C16H20N2O4/c1-10(2)15-14(9-19)17(4)18(16(15)21)12-5-7-13(8-6-12)22-11(3)20/h5-8,10,19H,9H2,1-4H3
InChIKey ZKTRECWBJULHQP-UHFFFAOYSA-N
Mol Weight 304.35 g/mol
Molecular Formula C16H20N2O4
Exact Mass 304.142307 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B2h0gGuTYp6
Name 1-(p-acetoxyphenyl)-2-methyl-3-hydroxymethyl-4-(prop-2-yl)-2,5-dihydropyrazole-5-one
Alternate Name(s) 4-[3-(hydroxymethyl)-4-isopropyl-2-methyl-5-oxo-2,5-dihydro-1H-pyrazol-1-yl]phenyl acetate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H20N2O4
InChI InChI=1S/C16H20N2O4/c1-10(2)15-14(9-19)17(4)18(16(15)21)12-5-7-13(8-6-12)22-11(3)20/h5-8,10,19H,9H2,1-4H3
InChIKey ZKTRECWBJULHQP-UHFFFAOYSA-N
Molecular Weight 304.346 g/mol
SMILES OCC=1N(C)N(C(C1C(C)C)=O)c1ccc(OC(=O)C)cc1
SPLASH splash10-054k-9650000000-48f3eddb69468c99958f
Source of Spectrum CJ-1992-0-0
Wiley ID 1306341