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(S)-1-(Benzyloxy)hept-5-yn-2-ol
SpectraBase Compound ID 1V5qPS5z0se
InChI InChI=1S/C14H18O2/c1-2-3-5-10-14(15)12-16-11-13-8-6-4-7-9-13/h4,6-9,14-15H,5,10-12H2,1H3/t14-/m0/s1
InChIKey WYRIBMJBXGSCKK-AWEZNQCLSA-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 6GGzViMQsvo
Name (S)-1-(Benzyloxy)hept-5-yn-2-ol
Appearance Colorless oil
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 218.130679818 u
Formula C14H18O2
InChI InChI=1S/C14H18O2/c1-2-3-5-10-14(15)12-16-11-13-8-6-4-7-9-13/h4,6-9,14-15H,5,10-12H2,1H3/t14-/m0/s1
InChIKey WYRIBMJBXGSCKK-AWEZNQCLSA-N
Instrument Name Finnigan MAT 8200
Ionization Type EI
Literature Reference DOI 10.1002/chem.201404873
Molecular Weight 218.296 g/mol
Optical Rotation [a]D20 = -14 (c = 1.0, CHCl3)
Quality 282
Reported Formula C14H18O2
SMILES O[C@](COCC1=CC=CC=C1)(CCC#CC)[H]
SPLASH splash10-0006-9000000000-97cba73fde3bf0f7c7ce
Source of Spectrum QE-21-SM8-S20 (DOI: 10.1002/chem.201404873)
Wiley ID 1906303