SpectraBase Compound ID | CkLPCNyD4fW |
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InChI | InChI=1S/C60H39Br3/c61-58-37(28-25-34-13-1-4-16-40(34)58)31-49-43-19-7-10-22-46(43)52-55(49)53-47-23-11-8-20-44(47)50(32-38-29-26-35-14-2-5-17-41(35)59(38)62)57(53)54-48-24-12-9-21-45(48)51(56(52)54)33-39-30-27-36-15-3-6-18-42(36)60(39)63/h1-30,49-51H,31-33H2 |
InChIKey | MQFKZHHSBOEBJO-UHFFFAOYSA-N |
Mol Weight | 999.7 g/mol |
Molecular Formula | C60H39Br3 |
Exact Mass | 996.06019 g/mol |
SpectraBase Spectrum ID | BO5YXvsuAGt |
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Name | anti-5,10,15-Tris(1-bromo-2-naphthylmethyl)-10,15-dihydro-5H-diindeno[1,2-a;1',2'-c]fluorene |
Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula | C60H39Br3 |
InChI | InChI=1S/C60H39Br3/c61-58-37(28-25-34-13-1-4-16-40(34)58)31-49-43-19-7-10-22-46(43)52-55(49)53-47-23-11-8-20-44(47)50(32-38-29-26-35-14-2-5-17-41(35)59(38)62)57(53)54-48-24-12-9-21-45(48)51(56(52)54)33-39-30-27-36-15-3-6-18-42(36)60(39)63/h1-30,49-51H,31-33H2 |
InChIKey | MQFKZHHSBOEBJO-UHFFFAOYSA-N |
Molecular Weight | 999.684 g/mol |
SMILES | c-12c3c(-c4ccccc4C3Cc3c(c4ccccc4cc3)Br)c3c(c2C(Cc2c(c4ccccc4cc2)Br)c2c1cccc2)-c1c(cccc1)C3Cc1c(c2ccccc2cc1)Br |
SPLASH | splash10-002r-0009111400-12055774d11f84e0f04b |
Source of Spectrum | QF-10-2606-12 |
Synonyms | syn-5,10,15-Tris(1-bromo-2-naphthylmethyl)-10,15-dihydro-5H-diindeno[1,2-a;1',2'-c]fluorene 9,18,27-tris[(1-bromonaphthalen-2-yl)methyl]heptacyclo[18.7.0.0(2,10).0(3,8).0(11,19).0(12,17).0(21,26)]heptacosa-1(20),2(10),3(8),4,6,11(19),12(17),13,15,21(26),22,24-dodecaene |
Wiley ID | 1559483 |