SpectraBase Compound ID | 76mZX2w4Or5 |
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InChI | InChI=1S/C16H18/c1-3-5-6-7-8-9-13-16-14-11-10-12-15(16)4-2/h2,10-12,14H,3,5-8H2,1H3 |
InChIKey | DPIAHVUVDUTVSB-UHFFFAOYSA-N |
Mol Weight | 210.32 g/mol |
Molecular Formula | C16H18 |
Exact Mass | 210.140851 g/mol |
SpectraBase Spectrum ID | AGiNtVE6Agp |
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Name | 1-Ethynyl-2-oct-1-ynyl-benzene |
CAS Registry Number | 121221-90-7 |
Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula | C16H18 |
InChI | InChI=1S/C16H18/c1-3-5-6-7-8-9-13-16-14-11-10-12-15(16)4-2/h2,10-12,14H,3,5-8H2,1H3 |
InChIKey | DPIAHVUVDUTVSB-UHFFFAOYSA-N |
Molecular Weight | 210.320 g/mol |
SMILES | C(#CCCCCCC)c1c(C#C)cccc1 |
SPLASH | splash10-014u-0910000000-18225c1d833bc0a1301a |
Source of Spectrum | KC-1989-480-13 |
Wiley ID | 1210064 |