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4-heptyl-3-methyl-1-(methylsulfonyl)pyrazol-5-ol

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4-heptyl-3-methyl-1-(methylsulfonyl)pyrazol-5-ol
SpectraBase Compound ID 8MTeRq93s9W
InChI InChI=1S/C12H22N2O3S/c1-4-5-6-7-8-9-11-10(2)13-14(12(11)15)18(3,16)17/h15H,4-9H2,1-3H3
InChIKey PJXNITVKACUHBF-UHFFFAOYSA-N
Mol Weight 274.38 g/mol
Molecular Formula C12H22N2O3S
Exact Mass 274.135114 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 5HWNBlYrsc0
Name 4-HEPTYL-3-METHYL-1-(METHYLSULFONYL)PYRAZOL-5-OL
Source of Sample Maybridge Chemical Company Ltd., North Cornwall, England
Copyright Copyright © 1991-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H22N2O3S
InChI InChI=1S/C12H22N2O3S/c1-4-5-6-7-8-9-11-10(2)13-14(12(11)15)18(3,16)17/h15H,4-9H2,1-3H3
InChIKey PJXNITVKACUHBF-UHFFFAOYSA-N
Instrument Name BRUKER AC-300
Melting Point 51-54C
Molecular Weight 274.38
Solvent CDCl3; Reference=TMS; Temperature 297K