SpectraBase Compound ID | F3Eszc0y0iH |
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InChI | InChI=1S/C24H36/c1-2-8-14-20-19(13-7-1)21-15-9-3-4-11-17-23(21)24-18-12-6-5-10-16-22(20)24/h1-18H2 |
InChIKey | VBIUHSAZNSYTGS-UHFFFAOYSA-N |
Mol Weight | 324.6 g/mol |
Molecular Formula | C24H36 |
Exact Mass | 324.281701 g/mol |
SpectraBase Spectrum ID | 4sdnAkhZIke |
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Name | Tricyclooctabenzene |
CAS Registry Number | 7099-19-6 |
Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula | C24H36 |
InChI | InChI=1S/C24H36/c1-2-8-14-20-19(13-7-1)21-15-9-3-4-11-17-23(21)24-18-12-6-5-10-16-22(20)24/h1-18H2 |
InChIKey | VBIUHSAZNSYTGS-UHFFFAOYSA-N |
Molecular Weight | 324.552 g/mol |
SMILES | C1CCCc2c(CC1)c1c(c3c2CCCCCC3)CCCCCC1 |
SPLASH | splash10-00e9-4973000000-10d628b4ba9adca32dcb |
Source of Spectrum | HE-1986-746-0 |
Synonyms | Tricyclooctenobenzene Tris(hexamethylene)benzene 1,2,3,4,5,6,7,8,9,10,11,12,13,14,15,16,17,18-octadecahydrobenzo[1,2:3,4:5,6]tri[8]annulene |
Wiley ID | 1323767 |