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4-(3,5-Dimethyl-1H-pyrazol-1-yl)-4-oxo-1-butanol
SpectraBase Compound ID 5GXyRhi2WYY
InChI InChI=1S/C9H14N2O2/c1-7-6-8(2)11(10-7)9(13)4-3-5-12/h6,12H,3-5H2,1-2H3
InChIKey MCFPEVSVLJEHCV-UHFFFAOYSA-N
Mol Weight 182.22 g/mol
Molecular Formula C9H14N2O2
Exact Mass 182.105528 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Aca4T5UuYvT
Name 4-(3,5-Dimethyl-1H-pyrazol-1-yl)-4-oxo-1-butanol
Alternate Name(s) Butan-1-one, 4-hydroxy-1-(3,5-dimethyl-1-pyrazolyl)-
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H14N2O2
InChI InChI=1S/C9H14N2O2/c1-7-6-8(2)11(10-7)9(13)4-3-5-12/h6,12H,3-5H2,1-2H3
InChIKey MCFPEVSVLJEHCV-UHFFFAOYSA-N
Molecular Weight 182.223 g/mol
SMILES OCCCC([n]1nc(C)cc1C)=O
SPLASH splash10-0a4i-9700000000-f0d143fb40d3a5a60ad8
Source of Spectrum AD-0-2532-0
Wiley ID 1427876