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[(E)-hept-5-en-1,3-diynyl]benzene
SpectraBase Compound ID LtLmpYNvfAl
InChI InChI=1S/C13H10/c1-2-3-4-5-7-10-13-11-8-6-9-12-13/h2-3,6,8-9,11-12H,1H3/b3-2+
InChIKey OQOPFMDMSRLRRH-NSCUHMNNSA-N
Mol Weight 166.22 g/mol
Molecular Formula C13H10
Exact Mass 166.07825 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GMUTWS7fNDc
Name 1-Phenyl-hepta-5-trans-ene-1,3-diyne
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H10
InChI InChI=1S/C13H10/c1-2-3-4-5-7-10-13-11-8-6-9-12-13/h2-3,6,8-9,11-12H,1H3/b3-2+
InChIKey OQOPFMDMSRLRRH-NSCUHMNNSA-N
Literature Reference DOI 10.1002/jccs.200000152
Molecular Weight 166.223 g/mol
SMILES C(#CC#C\C=C\C)c1ccccc1
SPLASH splash10-014i-0900000000-7e2a88e2ec0feb887c3c
Source of Spectrum QA-47-1133-2
Synonyms (E)-hepta-5-en-1,3-diyn-1-ylbenzene
Wiley ID 1795157