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6-Phenyl-1-(thiophen-2-yl)hex-5-yn-1-ol
SpectraBase Compound ID I3752rZ1PHS
InChI InChI=1S/C16H16OS/c17-15(16-12-7-13-18-16)11-6-2-5-10-14-8-3-1-4-9-14/h1,3-4,7-9,12-13,15,17H,2,6,11H2
InChIKey PXGGWTCFQAXAEP-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 D7nna1K0wQI
Name 6-Phenyl-1-(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/c17-15(16-12-7-13-18-16)11-6-2-5-10-14-8-3-1-4-9-14/h1,3-4,7-9,12-13,15,17H,2,6,11H2
InChIKey PXGGWTCFQAXAEP-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 219
Reported Formula C16H16OS
SMILES OC(CCCC#CC1=CC=CC=C1)C=1SC=CC1
SPLASH splash10-02ci-0910000000-2290a9ae67f6b21e944b
Source of Spectrum ACI-56-SM11-1i (DOI: 10.1002/anie.201705964)
Wiley ID 1896420