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1,8-Bis(1-adamantyl)-1,3,5,7-octatetrayne
SpectraBase Compound ID 7t4DxGwbyF
InChI InChI=1S/C28H30/c1(3-5-7-27-15-21-9-22(16-27)11-23(10-21)17-27)2-4-6-8-28-18-24-12-25(19-28)14-26(13-24)20-28/h21-26H,9-20H2/t21-,22+,23-,24-,25+,26-,27+,28+
InChIKey NZCFONTURATRPN-XQERBIPMSA-N
Mol Weight 366.55 g/mol
Molecular Formula C28H30
Exact Mass 366.234751 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Ag4kLD9gBlJ
Name 1,8-Bis(1-adamantyl)-1,3,5,7-octatetrayne
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C28H30
InChI InChI=1S/C28H30/c1(3-5-7-27-15-21-9-22(16-27)11-23(10-21)17-27)2-4-6-8-28-18-24-12-25(19-28)14-26(13-24)20-28/h21-26H,9-20H2/t21-,22+,23-,24-,25+,26-,27+,28+
InChIKey NZCFONTURATRPN-XQERBIPMSA-N
Molecular Weight 366.548 g/mol
SMILES C12(C#CC#CC#CC#CC34C[C@]5(C[C@@](C4)(C[C@@](C3)(C5)[H])[H])[H])C[C@]3(C[C@@](C2)(C[C@@](C1)(C3)[H])[H])[H]
SPLASH splash10-014i-0009000000-b49ceedee9abc3c2b715
Source of Spectrum QE-6-59-8
Synonyms 1-[8-(1-adamantyl)-1,3,5,7-octatetraynyl]adamantane
Wiley ID 844594