![Benz[1,2-E;3,4-E':5,6-E'']tribenzo[L]acephenanthrylene](/api/spectrum/8y0X98iAbJJ/structure.png?h=300&w=458 "Benz[1,2-E;3,4-E':5,6-E'']tribenzo[L]acephenanthrylene")
| SpectraBase Compound ID | 8gVYYgHKCS1 |
|---|---|
| InChI | InChI=1S/C60H30/c1-4-13-37-31(10-1)22-25-34-28-46-52-40(49(34)37)16-7-19-43(52)55-58(46)56-44-20-8-17-41-51-36(27-24-33-12-3-6-15-39(33)51)30-48(53(41)44)60(56)57-45-21-9-18-42-50-35(29-47(54(42)45)59(55)57)26-23-32-11-2-5-14-38(32)50/h1-30H |
| InChIKey | GJCVYOZXFDDFCZ-UHFFFAOYSA-N |
| Mol Weight | 750.9 g/mol |
| Molecular Formula | C60H30 |
| Exact Mass | 750.234751 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 8y0X98iAbJJ |
|---|---|
| Name | Benz[1,2-e;3,4-e':5,6-e"]tribenzo[l]acephenanthrylene |
| Copyright | Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C60H30 |
| InChI | InChI=1S/C60H30/c1-4-13-37-31(10-1)22-25-34-28-46-52-40(49(34)37)16-7-19-43(52)55-58(46)56-44-20-8-17-41-51-36(27-24-33-12-3-6-15-39(33)51)30-48(53(41)44)60(56)57-45-21-9-18-42-50-35(29-47(54(42)45)59(55)57)26-23-32-11-2-5-14-38(32)50/h1-30H |
| InChIKey | GJCVYOZXFDDFCZ-UHFFFAOYSA-N |
| Molecular Weight | 750.900 g/mol |
| SMILES | c-12c(c3-c4c5c(cccc5-c3c-3c2-c2c5c(c6c7c(cccc7)ccc6cc35)ccc2)c2c(c4)ccc3c2cccc3)-c2cccc3c2c1cc1c3c2c(cccc2)cc1 |
| SPLASH | splash10-0udi-0001000900-b935dad042928396820a |
| Source of Spectrum | QF-10-2606-2 |
| Synonyms | Hexadecacyclo[40.15.1.1(4,16).1(23,35).0(2,41).0(3,21).0(6,15).0(9,14).0(22,40).0(25,34).0(28,33).0(44,53).0(47,52).0(54,58).0(20,60).0(39,59)]hexaconta-1(58),2(41),3(21),4,6,8,10,12,14,16,18,20(60),22(40),23,25(34),26,28,30,32,35(59),36,38,42,44,46,48,50,52,54,56-triacontaene |
| Wiley ID | 1559480 |