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1-Phenyl-6-(thiophen-2-yl)hex-5-yn-1-ol
SpectraBase Compound ID C6uJWizcNtP
InChI InChI=1S/C16H16OS/c17-16(14-8-3-1-4-9-14)12-6-2-5-10-15-11-7-13-18-15/h1,3-4,7-9,11,13,16-17H,2,6,12H2
InChIKey BMIWWFIKXMFFQV-UHFFFAOYSA-N
Mol Weight 256.36 g/mol
Molecular Formula C16H16OS
Exact Mass 256.092186 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Lak14qDRgpg
Name 1-Phenyl-6-(thiophen-2-yl)hex-5-yn-1-ol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 256.092186308 u
Formula C16H16OS
InChI InChI=1S/C16H16OS/c17-16(14-8-3-1-4-9-14)12-6-2-5-10-15-11-7-13-18-15/h1,3-4,7-9,11,13,16-17H,2,6,12H2
InChIKey BMIWWFIKXMFFQV-UHFFFAOYSA-N
Instrument Name Finnigan SSQ or 7000 Thermo Deca XP
Ionization Type EI
Literature Reference DOI 10.1002/anie.201705964
Molecular Weight 256.363 g/mol
Quality 361
Reported Formula C16H16OS
SMILES OC(C1=CC=CC=C1)CCCC#CC=1SC=CC1
SPLASH splash10-002r-5920000000-1e06603f2ba22fc9bba6
Source of Spectrum ACI-56-SM9-1e (DOI: 10.1002/anie.201705964)
Wiley ID 1896417