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1-(2-Phenylethynyl)adamantane
SpectraBase Compound ID 62hmTeubjgg
InChI InChI=1S/C18H20/c1-2-4-14(5-3-1)6-7-18-11-15-8-16(12-18)10-17(9-15)13-18/h1-5,15-17H,8-13H2/t15-,16+,17-,18+
InChIKey NILZZMRDRCUCON-USTZCAOPSA-N
Mol Weight 236.36 g/mol
Molecular Formula C18H20
Exact Mass 236.156501 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1NEya5zEdVY
Name 1-(2-Phenylethynyl)adamantane
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H20
InChI InChI=1S/C18H20/c1-2-4-14(5-3-1)6-7-18-11-15-8-16(12-18)10-17(9-15)13-18/h1-5,15-17H,8-13H2/t15-,16+,17-,18+
InChIKey NILZZMRDRCUCON-USTZCAOPSA-N
Molecular Weight 236.358 g/mol
SMILES C12(C[C@]3(C[C@](C[C@@](C2)(C3)[H])(C1)[H])[H])C#Cc1ccccc1
SPLASH splash10-000i-0980000000-d1d5135bb9d0fa1bb325
Source of Spectrum K1-2007-246-0
Wiley ID 1639020