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3-Pyrazolidinone, 1-(3,5-dimethylphenyl)-4-(hydroxymethyl)-4-methyl-
SpectraBase Compound ID wfe3dMggNk
InChI InChI=1S/C13H18N2O2/c1-9-4-10(2)6-11(5-9)15-7-13(3,8-16)12(17)14-15/h4-6,16H,7-8H2,1-3H3,(H,14,17)
InChIKey CHUBQGUWRNXPBP-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 1WWDM8F7BaL
Name 3-Pyrazolidinone, 1-(3,5-dimethylphenyl)-4-(hydroxymethyl)-4-methyl-
Alternate Name(s) 1-(3,5-dimethylphenyl)-4-(hydroxymethyl)-4-methylpyrazolidin-3-one 1-(3,5-dimethylphenyl)-4-(hydroxymethyl)-4-methyl-3-pyrazolidinone 1-(3,5-dimethylphenyl)-4-(hydroxymethyl)-4-methyl-pyrazolidin-3-one
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Formula C13H18N2O2
InChI InChI=1S/C13H18N2O2/c1-9-4-10(2)6-11(5-9)15-7-13(3,8-16)12(17)14-15/h4-6,16H,7-8H2,1-3H3,(H,14,17)
InChIKey CHUBQGUWRNXPBP-UHFFFAOYSA-N
Molecular Weight 234.299 g/mol
SMILES OCC1(CN(c2cc(cc(C)c2)C)NC1=O)C
SPLASH splash10-001i-7790000000-97be6cd1d9df30611e45
Source of Spectrum JX-2015-1-3
Wiley ID 1720871