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6-Phenyl-1,1-di(thiophen-2-yl)hex-5-yn-1-ol
SpectraBase Compound ID 4LBDHjlNteY
InChI InChI=1S/C20H18OS2/c21-20(18-12-7-15-22-18,19-13-8-16-23-19)14-6-2-5-11-17-9-3-1-4-10-17/h1,3-4,7-10,12-13,15-16,21H,2,6,14H2
InChIKey YSUNAJJYBXJGDH-UHFFFAOYSA-N
Mol Weight 338.48 g/mol
Molecular Formula C20H18OS2
Exact Mass 338.079908 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DoyNQhyvCCa
Name 6-Phenyl-1,1-di(thiophen-2-yl)hex-5-yn-1-ol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 338.079907547 u
Formula C20H18OS2
InChI InChI=1S/C20H18OS2/c21-20(18-12-7-15-22-18,19-13-8-16-23-19)14-6-2-5-11-17-9-3-1-4-10-17/h1,3-4,7-10,12-13,15-16,21H,2,6,14H2
InChIKey YSUNAJJYBXJGDH-UHFFFAOYSA-N
Instrument Name Finnigan SSQ or 7000 Thermo Deca XP
Ionization Type EI
Literature Reference DOI 10.1002/anie.201705964
Molecular Weight 338.483 g/mol
Quality 104
Reported Formula C20H18OS2
SMILES OC(CCCC#CC=1C=CC=CC1)(C1=CC=CS1)C=1SC=CC1
SPLASH splash10-03ka-0941000000-919ff40455e910d00e29
Source of Spectrum ACI-56-SM12-1n (DOI: 10.1002/anie.201705964)
Wiley ID 1896423