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7-Phenylhept-1-en-6-yn-3-ol

View entire compound with spectra: 2 MS (GC)

7-Phenylhept-1-en-6-yn-3-ol
SpectraBase Compound ID Drmn1UPL0OM
InChI InChI=1S/C13H14O/c1-2-13(14)11-7-6-10-12-8-4-3-5-9-12/h2-5,8-9,13-14H,1,7,11H2
InChIKey FKKBVTATPMSDGM-UHFFFAOYSA-N
Mol Weight 186.25 g/mol
Molecular Formula C13H14O
Exact Mass 186.104465 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HEtCLCYf8WK
Name 7-Phenylhept-1-en-6-yn-3-ol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H14O
InChI InChI=1S/C13H14O/c1-2-13(14)11-7-6-10-12-8-4-3-5-9-12/h2-5,8-9,13-14H,1,7,11H2
InChIKey FKKBVTATPMSDGM-UHFFFAOYSA-N
Literature Reference DOI 10.1021/jo300374v
Molecular Weight 186.254 g/mol
SMILES OC(CCC#Cc1ccccc1)C=C
SPLASH splash10-00kf-8900000000-7d15e0213d1162aa5f11
Source of Spectrum J-77-4167/SMS4-11
Synonyms 7-Phenyl-3-hept-1-en-6-ynol
Wiley ID 1749763