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2-Phenyloct-3-yne-1,2-diol

View entire compound with spectra: 1 MS (GC)

2-Phenyloct-3-yne-1,2-diol
SpectraBase Compound ID 9jUYFsWp05z
InChI InChI=1S/C14H18O2/c1-2-3-4-8-11-14(16,12-15)13-9-6-5-7-10-13/h5-7,9-10,15-16H,2-4,12H2,1H3
InChIKey GLEPBQYEWQKVGO-UHFFFAOYSA-N
Mol Weight 218.3 g/mol
Molecular Formula C14H18O2
Exact Mass 218.13068 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5qjfgunuftf
Name 2-Phenyloct-3-yne-1,2-diol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H18O2
InChI InChI=1S/C14H18O2/c1-2-3-4-8-11-14(16,12-15)13-9-6-5-7-10-13/h5-7,9-10,15-16H,2-4,12H2,1H3
InChIKey GLEPBQYEWQKVGO-UHFFFAOYSA-N
Literature Reference DOI 10.1021/jo301628n
Molecular Weight 218.296 g/mol
SMILES OC(CO)(c1ccccc1)C#CCCCC
SPLASH splash10-05p9-4900000000-056ae1ac2bfa18f0a58a
Source of Spectrum J-77-8661-1b
Wiley ID 1747050