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4-[(4-Chlorophenyl)thio]-2-methylbut-3-yn-2-ol
SpectraBase Compound ID 4iCRL3ht1oG
InChI InChI=1S/C11H11ClOS/c1-11(2,13)7-8-14-10-5-3-9(12)4-6-10/h3-6,13H,1-2H3
InChIKey YZOXAEVBSVAJFS-UHFFFAOYSA-N
Mol Weight 226.72 g/mol
Molecular Formula C11H11ClOS
Exact Mass 226.021914 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID A1VuersLYVy
Name 4-[(4-Chlorophenyl)thio]-2-methylbut-3-yn-2-ol
Appearance White Solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 226.021913847 u
Formula C11H11ClOS
InChI InChI=1S/C11H11ClOS/c1-11(2,13)7-8-14-10-5-3-9(12)4-6-10/h3-6,13H,1-2H3
InChIKey YZOXAEVBSVAJFS-UHFFFAOYSA-N
Instrument Name Shimadzu GC-MS-QP2010
Ionization Type EI
Literature Reference DOI 10.1002/chem.201702493
Molecular Weight 226.721 g/mol
Quality 24
Reported Formula C11H11ClOS
SMILES OC(C#CSC=1C=CC(=CC1)Cl)(C)C
SPLASH splash10-0006-9000000000-91e564ca9ecf49ef899a
Source of Spectrum QE-23-SM6-3k (DOI: 10.1002/chem.201702493)
Wiley ID 1905886