SpectraBase Compound ID | LMEoKlIinV8 |
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InChI | InChI=1S/C17H15I/c1-14-2-5-3(14)7-4(14)6(2)15(5,7)16-8-11-9(16)13-10(16)12(8)17(11,13)18/h2-13H,1H3/t2-,3+,4-,5-,6+,7-,8-,9+,10-,11-,12+,13-,14+,15-,16-,17- |
InChIKey | KHJQALBVYKKJCR-VAULDLTQSA-N |
Mol Weight | 346.21 g/mol |
Molecular Formula | C17H15I |
Exact Mass | 346.021845 g/mol |
SpectraBase Spectrum ID | C3AfwEaDE6H |
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Name | 4'-Methyl-p-[2]cubyl Iodide |
Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula | C17H15I |
InChI | InChI=1S/C17H15I/c1-14-2-5-3(14)7-4(14)6(2)15(5,7)16-8-11-9(16)13-10(16)12(8)17(11,13)18/h2-13H,1H3/t2-,3+,4-,5-,6+,7-,8-,9+,10-,11-,12+,13-,14+,15-,16-,17- |
InChIKey | KHJQALBVYKKJCR-VAULDLTQSA-N |
Molecular Weight | 346.211 g/mol |
SMILES | C12(C34C5C6C7(C5C4C7C36)C)C3C4C5(C3C2C5C14)I |
SPLASH | splash10-0udi-3690000000-2ee01b5c3135fb078b45 |
Source of Spectrum | C-121-4121-21 |
Synonyms | 1-iodo-4-(4-methyl-1-cubanyl)cubane 1-iodanyl-4-(4-methylcuban-1-yl)cubane |
Wiley ID | 1702449 |