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5-Methylene-2-(2-phenylethynyl)oxocane

View entire compound with spectra: 1 MS (GC)

5-Methylene-2-(2-phenylethynyl)oxocane
SpectraBase Compound ID 1XJTbqjfIt5
InChI InChI=1S/C16H18O/c1-14-6-5-13-17-16(11-9-14)12-10-15-7-3-2-4-8-15/h2-4,7-8,16H,1,5-6,9,11,13H2
InChIKey KBPLXLCFRAYJIF-UHFFFAOYSA-N
Mol Weight 226.32 g/mol
Molecular Formula C16H18O
Exact Mass 226.135765 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2uW0CCzul07
Name 5-Methylene-2-(2-phenylethynyl)oxocane
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H18O
InChI InChI=1S/C16H18O/c1-14-6-5-13-17-16(11-9-14)12-10-15-7-3-2-4-8-15/h2-4,7-8,16H,1,5-6,9,11,13H2
InChIKey KBPLXLCFRAYJIF-UHFFFAOYSA-N
Molecular Weight 226.319 g/mol
SMILES C(#CC1OCCCC(CC1)=C)c1ccccc1
SPLASH splash10-016r-0900000000-8002011457cc7f032297
Source of Spectrum F-56-2208-23
Synonyms 5-Methylidene-2-(2-phenylethynyl)oxocane
Wiley ID 856497