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3-Phenylthiomethyl-5-hydroxymethylisoxazole
SpectraBase Compound ID 79fM4dU9ux5
InChI InChI=1S/C11H11NO2S/c13-7-10-6-9(12-14-10)8-15-11-4-2-1-3-5-11/h1-6,13H,7-8H2
InChIKey QHUVFSOYJBYVDV-UHFFFAOYSA-N
Mol Weight 221.27 g/mol
Molecular Formula C11H11NO2S
Exact Mass 221.05105 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3XyIcDBD1YC
Name 3-Phenylthiomethyl-5-hydroxymethylisoxazole
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H11NO2S
InChI InChI=1S/C11H11NO2S/c13-7-10-6-9(12-14-10)8-15-11-4-2-1-3-5-11/h1-6,13H,7-8H2
InChIKey QHUVFSOYJBYVDV-UHFFFAOYSA-N
Molecular Weight 221.274 g/mol
SMILES OCc1onc(c1)CSc1ccccc1
SPLASH splash10-0q5j-9400000000-a7469b6c85dafba21876
Source of Spectrum AJ-61-3978-7
Synonyms {3-[(phenylsulfanyl)methyl]-5-isoxazolyl}methanol
Wiley ID 1221122