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1-(3,4-dimethylphenyl)-4-(hydroxymethyl)-4-methylpyrazolidin-3-one
SpectraBase Compound ID GTOfsThW5K1
InChI InChI=1S/C13H18N2O2/c1-9-4-5-11(6-10(9)2)15-7-13(3,8-16)12(17)14-15/h4-6,16H,7-8H2,1-3H3,(H,14,17)
InChIKey XGNFGPFKRNWFGA-UHFFFAOYSA-N
Mol Weight 234.3 g/mol
Molecular Formula C13H18N2O2
Exact Mass 234.136828 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BrdCn06sYeb
Name 1-(3,4-dimethylphenyl)-4-(hydroxymethyl)-4-methylpyrazolidin-3-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H18N2O2
InChI InChI=1S/C13H18N2O2/c1-9-4-5-11(6-10(9)2)15-7-13(3,8-16)12(17)14-15/h4-6,16H,7-8H2,1-3H3,(H,14,17)
InChIKey XGNFGPFKRNWFGA-UHFFFAOYSA-N
Molecular Weight 234.299 g/mol
SMILES OCC1(CN(c2ccc(C)c(c2)C)NC1=O)C
SPLASH splash10-053r-7950000000-338db515ff39b0028f62
Source of Spectrum JX-2015-1-4
Synonyms 1-(3,4-dimethylphenyl)-4-(hydroxymethyl)-4-methyl-3-pyrazolidinone 1-(3,4-dimethylphenyl)-4-(hydroxymethyl)-4-methyl-pyrazolidin-3-one
Wiley ID 1720872