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4,4,4-Trichloro-2-methyl-2-(phenylthio)butan-1-ol
SpectraBase Compound ID 7XBdgN1qZan
InChI InChI=1S/C11H13Cl3OS/c1-10(8-15,7-11(12,13)14)16-9-5-3-2-4-6-9/h2-6,15H,7-8H2,1H3
InChIKey DQROWGMPXJUDPS-UHFFFAOYSA-N
Mol Weight 299.64 g/mol
Molecular Formula C11H13Cl3OS
Exact Mass 297.975269 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HAmm3LHvXBl
Name 4,4,4-Trichloro-2-methyl-2-(phenylthio)butan-1-ol
Appearance Colorless oil
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H13Cl3OS
InChI InChI=1S/C11H13Cl3OS/c1-10(8-15,7-11(12,13)14)16-9-5-3-2-4-6-9/h2-6,15H,7-8H2,1H3
InChIKey DQROWGMPXJUDPS-UHFFFAOYSA-N
Ionization Type EI
Literature Reference DOI 10.1002/adsc.202000657
Molecular Weight 299.643 g/mol
Reported Formula C11H13Cl3OS
SMILES OCC(CC(Cl)(Cl)Cl)(C)Sc1ccccc1
SPLASH splash10-03y0-4960000000-16ffaa2959b06142e397
Source of Spectrum ASC-362-SM14-3l
Wiley ID 1855539