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Acetic acid (3-hydroxy-4,4-dimethyl-2-p-toluoyl-2-pyrazolin-3-yl)methyl ester
SpectraBase Compound ID EhuleH8cXxF
InChI InChI=1S/C16H20N2O4/c1-11-5-7-13(8-6-11)14(20)18-16(21,10-22-12(2)19)15(3,4)9-17-18/h5-9,21H,10H2,1-4H3
InChIKey LHMWRMCXNDBYHX-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 3lA0DLMfSez
Name Acetic acid (3-hydroxy-4,4-dimethyl-2-p-toluoyl-2-pyrazolin-3-yl)methyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H20N2O4
InChI InChI=1S/C16H20N2O4/c1-11-5-7-13(8-6-11)14(20)18-16(21,10-22-12(2)19)15(3,4)9-17-18/h5-9,21H,10H2,1-4H3
InChIKey LHMWRMCXNDBYHX-UHFFFAOYSA-N
Molecular Weight 304.346 g/mol
SMILES OC1(N(N=CC1(C)C)C(c1ccc(cc1)C)=O)COC(=O)C
SPLASH splash10-014i-0930000000-1b371b5ab50bd09386ec
Source of Spectrum Y-28-51-8
Synonyms [3-hydroxy-4,4-dimethyl-2-(4-methylbenzoyl)pyrazol-3-yl]methyl acetate [4,4-dimethyl-2-(4-methylphenyl)carbonyl-3-oxidanyl-pyrazol-3-yl]methyl ethanoate
Wiley ID 1306352