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(S)-1-(p-Tolylsulfenyl)-3-heptyn-2-ol

View entire compound with spectra: 1 MS (GC)

(S)-1-(p-Tolylsulfenyl)-3-heptyn-2-ol
SpectraBase Compound ID 3WiV0VfjwIt
InChI InChI=1S/C14H18OS/c1-3-4-5-6-13(15)11-16-14-9-7-12(2)8-10-14/h7-10,13,15H,3-4,11H2,1-2H3/t13-/m0/s1
InChIKey KUIQPSXQSSKXHW-ZDUSSCGKSA-N
Mol Weight 234.36 g/mol
Molecular Formula C14H18OS
Exact Mass 234.107836 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DeNpxdJ1Tth
Name (S)-1-(p-Tolylsulfenyl)-3-heptyn-2-ol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H18OS
InChI InChI=1S/C14H18OS/c1-3-4-5-6-13(15)11-16-14-9-7-12(2)8-10-14/h7-10,13,15H,3-4,11H2,1-2H3/t13-/m0/s1
InChIKey KUIQPSXQSSKXHW-ZDUSSCGKSA-N
Molecular Weight 234.357 g/mol
SMILES O[C@@](C#CCCC)(CSc1ccc(cc1)C)[H]
SPLASH splash10-000i-1920000000-c44473c7fce740c85941
Source of Spectrum QC-10-953-4
Synonyms (2S)-1-[(4-methylphenyl)sulfanyl]-3-heptyn-2-ol
Wiley ID 871160