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2,9-Dioxa[10]orthocyclophane-5-yne
SpectraBase Compound ID 7mOlOH8Hajy
InChI InChI=1S/C14H16O2/c1-2-6-10-16-12-14-8-4-3-7-13(14)11-15-9-5-1/h3-4,7-8H,5-6,9-12H2
InChIKey BTHPQEYEINGEDE-UHFFFAOYSA-N
Mol Weight 216.28 g/mol
Molecular Formula C14H16O2
Exact Mass 216.11503 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID L8gDUsHrMzG
Name 2,9-Dioxa[10]orthocyclophane-5-yne
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H16O2
InChI InChI=1S/C14H16O2/c1-2-6-10-16-12-14-8-4-3-7-13(14)11-15-9-5-1/h3-4,7-8H,5-6,9-12H2
InChIKey BTHPQEYEINGEDE-UHFFFAOYSA-N
Literature Reference DOI 10.1021/ol800154y
Molecular Weight 216.280 g/mol
SMILES c1cccc2COCCC#CCCOCc12
SPLASH splash10-00di-2900000000-d572f08ba697117d5c91
Source of Spectrum A1-10-981/SM4-3a
Wiley ID 1759281