SpectraBase Compound ID | LMhq3t363JG |
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InChI | InChI=1S/C21H16/c1-2-8-15-14(7-1)13-20-16-9-3-5-11-18(16)21(15)19-12-6-4-10-17(19)20/h1-12,20-21H,13H2/t20-,21+ |
InChIKey | NHYVQMNOPSDSOR-OYRHEFFESA-N |
Mol Weight | 268.36 g/mol |
Molecular Formula | C21H16 |
Exact Mass | 268.125201 g/mol |
SpectraBase Spectrum ID | 92E56p2w4Ds |
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Name | 5,10-o-Benzeno-5H-dibenzo[a,d]cycloheptene, 10,11-dihydro- |
CAS Registry Number | 24098-00-8 |
Comments | Less than 3 mono-isotopic peaks |
Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula | C21H16 |
InChI | InChI=1S/C21H16/c1-2-8-15-14(7-1)13-20-16-9-3-5-11-18(16)21(15)19-12-6-4-10-17(19)20/h1-12,20-21H,13H2/t20-,21+ |
InChIKey | NHYVQMNOPSDSOR-OYRHEFFESA-N |
Molecular Weight | 268.359 g/mol |
SMILES | [C@]12(c3c(cccc3)[C@@](c3c1cccc3)(Cc1c2cccc1)[H])[H] |
SPLASH | splash10-014i-0090000000-c369b8e2e0be9fa8fb70 |
Source of Spectrum | K-118-2901-8 |
Synonyms | Homotrypticene 9,10-Dihydro-9,10-[(ortho-benzeno)methyl]anthracene 5,10[1',2']-Benzeno-5H-dibenzo[a,d]cycloheptene, 10,11-dihydro- Homotriptycene pentacyclo[7.6.6.0(2,7).0(10,15).0(16,21)]henicosa-2,4,6,10,12,14,16,18,20-nonaene Tribenzo[b,f,i]bicyclo[3.2.2]nona-2,6,8-triene |
Wiley ID | 1272900 |