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1-(3-Chlorophenyl)-3-cyclohexylprop-2-yn-1-ol
SpectraBase Compound ID 8H0aNnXVHf8
InChI InChI=1S/C15H17ClO/c16-14-8-4-7-13(11-14)15(17)10-9-12-5-2-1-3-6-12/h4,7-8,11-12,15,17H,1-3,5-6H2
InChIKey YRNOANZGXINHJO-UHFFFAOYSA-N
Mol Weight 248.75 g/mol
Molecular Formula C15H17ClO
Exact Mass 248.096793 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LE2CNpPEyZN
Name 1-(3-Chlorophenyl)-3-cyclohexylprop-2-yn-1-ol
Appearance Colorless liquid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 248.096792866 u
Formula C15H17ClO
InChI InChI=1S/C15H17ClO/c16-14-8-4-7-13(11-14)15(17)10-9-12-5-2-1-3-6-12/h4,7-8,11-12,15,17H,1-3,5-6H2
InChIKey YRNOANZGXINHJO-UHFFFAOYSA-N
Instrument Name Hewlett-Packard 6890 or 5890 Series II
Ionization Type EI
Literature Reference DOI 10.1002/anie.201704400
Molecular Weight 248.753 g/mol
Quality 93
Reported Formula C15H17ClO
SMILES OC(C1=CC(Cl)=CC=C1)C#CC1CCCCC1
SPLASH splash10-03di-0590000000-3b1f1e045fa672b064c7
Source of Spectrum ACI-56-SM15-12a (DOI: 10.1002/anie.201704400)
Wiley ID 1896175