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1-Phenylethynyl-2-heptanol

View entire compound with spectra: 1 MS (GC)

1-Phenylethynyl-2-heptanol
SpectraBase Compound ID FT0i1167LvK
InChI InChI=1S/C15H20O/c1-3-4-8-12-15(2,16)13-11-14-9-6-5-7-10-14/h5-7,9-10,16H,3-4,8,12H2,1-2H3
InChIKey ZYPWGWHGJLHCJQ-UHFFFAOYSA-N
Mol Weight 216.32 g/mol
Molecular Formula C15H20O
Exact Mass 216.151415 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BLRUKhmptGA
Name 1-Phenylethynyl-2-heptanol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H20O
InChI InChI=1S/C15H20O/c1-3-4-8-12-15(2,16)13-11-14-9-6-5-7-10-14/h5-7,9-10,16H,3-4,8,12H2,1-2H3
InChIKey ZYPWGWHGJLHCJQ-UHFFFAOYSA-N
Molecular Weight 216.324 g/mol
SMILES OC(C#Cc1ccccc1)(CCCCC)C
SPLASH splash10-0002-0900000000-947b1ffa7bbf9186b32a
Source of Spectrum QB-17-382-3
Synonyms 1-Phenyl-1-nonyn-4-ol 1-Phenylnon-1-yn-4-ol 2-(Phenylethynyl)-2-heptanol 3-Methyl-1-phenyl-1-octyn-3-ol 3-Methyl-1-phenyloct-1-yn-3-ol
Wiley ID 841686