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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 IhdrwG01xSU
Name - phenylhept-1-en-6-yn-3-ol
Appearance Yellow oil
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
Instrument Name VG Analytical 70-250-SE
Ionization Type EI
Literature Reference DOI 10.1021/jm1014296
Molecular Weight 186.254 g/mol
Reported Formula C13H14O
SMILES OC(C=C)CCC#Cc1ccccc1
SPLASH splash10-014i-0900000000-34b47f78c5aa8243e4d0
Source of Spectrum AF-54-SM20-21
Wiley ID 1848810