| SpectraBase Spectrum ID |
Woi0w1BYJJ |
| Name |
2,3-Di(4-tert-butylphenyl)-6,13-dihydro-6.13-theno-pentacene-15,16-dione |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C44H38O2 |
| InChI |
InChI=1S/C44H38O2/c1-43(2,3)31-15-11-25(12-16-31)33-21-29-23-37-38(24-30(29)22-34(33)26-13-17-32(18-14-26)44(4,5)6)40-36-20-28-10-8-7-9-27(28)19-35(36)39(37)41(45)42(40)46/h7-24,39-40H,1-6H3/t39-,40+ |
| InChIKey |
PXTSLWQVIXBWIQ-LQDDJWCHSA-N |
| Molecular Weight |
598.786 g/mol |
| SMILES |
[C@@]12(C(C(=O)[C@@](c3c2cc2c(cccc2)c3)(c2c1cc1c(cc(c(c1)-c1ccc(C(C)(C)C)cc1)-c1ccc(C(C)(C)C)cc1)c2)[H])=O)[H] |
| SPLASH |
splash10-01ox-0000590000-2a681cf0b6bf54742703 |
| Source of Spectrum |
J-73-5512-7b |
| Wiley ID |
1668482 |
