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[(p-Ethynylphenyl)ethynyl]-adamantane

View entire compound with spectra: 1 MS (GC)

[(p-Ethynylphenyl)ethynyl]-adamantane
SpectraBase Compound ID ENrMyfp3AYd
InChI InChI=1S/C20H20/c1-2-15-3-5-16(6-4-15)7-8-20-12-17-9-18(13-20)11-19(10-17)14-20/h1,3-6,17-19H,9-14H2/t17-,18+,19-,20+
InChIKey JTYPBGSTMRZCRE-FGYAAKKASA-N
Mol Weight 260.38 g/mol
Molecular Formula C20H20
Exact Mass 260.156501 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GSXcdzcKD9p
Name [(p-Ethynylphenyl)ethynyl]-adamantane
Alternate Name(s) 1-[(4-Ethynylphenyl)ethynyl]adamantane
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H20
InChI InChI=1S/C20H20/c1-2-15-3-5-16(6-4-15)7-8-20-12-17-9-18(13-20)11-19(10-17)14-20/h1,3-6,17-19H,9-14H2/t17-,18+,19-,20+
InChIKey JTYPBGSTMRZCRE-FGYAAKKASA-N
Molecular Weight 260.380 g/mol
SMILES C12(C[C@]3(C[C@](C[C@@](C2)(C3)[H])(C1)[H])[H])C#Cc1ccc(cc1)C#C
SPLASH splash10-0ik9-0390000000-c052325ec7e4131277a3
Source of Spectrum K1-2007-246-0
Wiley ID 1639018