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4-((3-chlorophenyl)thio)-1-(2-hydroxyethyl)-3-methyl-1H-pyrazol-5-ol

View entire compound with spectra: 1 MS (GC)

4-((3-chlorophenyl)thio)-1-(2-hydroxyethyl)-3-methyl-1H-pyrazol-5-ol
SpectraBase Compound ID 8Gt9BM5Bvmn
InChI InChI=1S/C12H13ClN2O2S/c1-8-11(12(17)15(14-8)5-6-16)18-10-4-2-3-9(13)7-10/h2-4,7,16-17H,5-6H2,1H3
InChIKey IPCVFPVTKIGBDS-UHFFFAOYSA-N
Mol Weight 284.76 g/mol
Molecular Formula C12H13ClN2O2S
Exact Mass 284.038627 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B1Is2JG9jMW
Name 4-((3-chlorophenyl)thio)-1-(2-hydroxyethyl)-3-methyl-1H-pyrazol-5-ol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H13ClN2O2S
InChI InChI=1S/C12H13ClN2O2S/c1-8-11(12(17)15(14-8)5-6-16)18-10-4-2-3-9(13)7-10/h2-4,7,16-17H,5-6H2,1H3
InChIKey IPCVFPVTKIGBDS-UHFFFAOYSA-N
Literature Reference DOI 10.1039/c4cc05237d
Molecular Weight 284.761 g/mol
SMILES Oc1[n](CCO)nc(c1Sc1cc(ccc1)Cl)C
SPLASH splash10-001u-0390000000-caccf3cbc09dc84ea68e
Source of Spectrum KD-50-13121/SM-3m
Wiley ID 1754894