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8,9;27,28;29,30;31,32-Tetrabenzopentadecacyclo[24.2.2.2(7,10).0(2,22).0(2,25).0(3,14).0(4,21).0(5,13).0(6,20).0(11,18).0(12,16).0(15,25).0(17,24).0(19,23)]dotriacontane
SpectraBase Compound ID ILi5TTNZge5
InChI InChI=1S/C48H36/c1-5-13-21-17(9-1)33-18-10-2-6-14-22(18)35(21)47-41-29-28-26-25-27-30-38(26)46-34-19-11-3-7-15-23(19)36(24-16-8-4-12-20(24)34)48(46)42(30)31(39(27)45(33,47)37(25)29)43(47)44(48)32(41)40(28)46/h1-16,25-44H
InChIKey YNFBAPROILGOAP-UHFFFAOYSA-N
Mol Weight 612.8 g/mol
Molecular Formula C48H36
Exact Mass 612.281701 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Fgi4cjxQzDU
Name 8,9;27,28;29,30;31,32-Tetrabenzopentadecacyclo[24.2.2.2(7,10).0(2,22).0(2,25).0(3,14).0(4,21).0(5,13).0(6,20).0(11,18).0(12,16).0(15,25).0(17,24).0(19,23)]dotriacontane
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C48H36
InChI InChI=1S/C48H36/c1-5-13-21-17(9-1)33-18-10-2-6-14-22(18)35(21)47-41-29-28-26-25-27-30-38(26)46-34-19-11-3-7-15-23(19)36(24-16-8-4-12-20(24)34)48(46)42(30)31(39(27)45(33,47)37(25)29)43(47)44(48)32(41)40(28)46/h1-16,25-44H
InChIKey YNFBAPROILGOAP-UHFFFAOYSA-N
Molecular Weight 612.816 g/mol
SMILES C123C4(C5c6c(C3c3c5cccc3)cccc6)C3C5C6C4C4C7C6C6C5C5C3C1C1C5C63C5c6ccccc6C(C73C1C24)c1ccccc51
SPLASH splash10-004i-0900000000-f721da2da0707238e44b
Source of Spectrum QE-8-520-26
Wiley ID 1557149