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1-(hex-1-ynyl)cyclopropyl 4-methylbenzenesulfonate
SpectraBase Compound ID 4EgUWHJ7AT9
InChI InChI=1S/C16H20O3S/c1-3-4-5-6-11-16(12-13-16)19-20(17,18)15-9-7-14(2)8-10-15/h7-10H,3-5,12-13H2,1-2H3
InChIKey UULBUUZSOBTKDG-UHFFFAOYSA-N
Mol Weight 292.39 g/mol
Molecular Formula C16H20O3S
Exact Mass 292.113316 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GHYkbYWv1JM
Name 1-(hex-1-ynyl)cyclopropyl 4-methylbenzenesulfonate
Alternate Name(s) 1-(hex-1-yn-1-yl)cyclopropyl 4-methylbenzenesulfonate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H20O3S
InChI InChI=1S/C16H20O3S/c1-3-4-5-6-11-16(12-13-16)19-20(17,18)15-9-7-14(2)8-10-15/h7-10H,3-5,12-13H2,1-2H3
InChIKey UULBUUZSOBTKDG-UHFFFAOYSA-N
Literature Reference DOI 10.1002/adsc.201600357
Molecular Weight 292.393 g/mol
SMILES C1C(C1)(OS(c1ccc(cc1)C)(=O)=O)C#CCCCC
SPLASH splash10-0a4l-9810000000-0cbe1cbbd81af3d986d5
Source of Spectrum ASC-358-2398/SM7-1b
Wiley ID 1807479