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Octakis(3,3-dimethyl-1-butenyl)naphthalene
SpectraBase Compound ID HVh8xkjGrf0
InChI InChI=1S/C58H88/c1-51(2,3)33-25-41-42(26-34-52(4,5)6)46(30-38-56(16,17)18)50-48(32-40-58(22,23)24)44(28-36-54(10,11)12)43(27-35-53(7,8)9)47(31-39-57(19,20)21)49(50)45(41)29-37-55(13,14)15/h25-40H,1-24H3/b33-25+,34-26+,35-27+,36-28+,37-29+,38-30+,39-31+,40-32+
InChIKey QMHGZCADPWRYHW-IKCPDLOESA-N
Mol Weight 785.3 g/mol
Molecular Formula C58H88
Exact Mass 784.688603 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9jxA2mQqCqc
Name Octakis(3,3-dimethyl-1-butenyl)naphthalene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C58H88
InChI InChI=1S/C58H88/c1-51(2,3)33-25-41-42(26-34-52(4,5)6)46(30-38-56(16,17)18)50-48(32-40-58(22,23)24)44(28-36-54(10,11)12)43(27-35-53(7,8)9)47(31-39-57(19,20)21)49(50)45(41)29-37-55(13,14)15/h25-40H,1-24H3/b33-25+,34-26+,35-27+,36-28+,37-29+,38-30+,39-31+,40-32+
InChIKey QMHGZCADPWRYHW-IKCPDLOESA-N
Molecular Weight 785.342 g/mol
SMILES c12c(c(\C=C\C(C)(C)C)c(c(c2\C=C\C(C)(C)C)\C=C\C(C)(C)C)\C=C\C(C)(C)C)c(\C=C\C(C)(C)C)c(c(c1\C=C\C(C)(C)C)\C=C\C(C)(C)C)\C=C\C(C)(C)C
SPLASH splash10-000i-0000000900-fa47be0c1230c52954eb
Source of Spectrum QE-11-318-27
Synonyms 1,2,3,4,5,6,7,8-octakis[(1E)-3,3-dimethyl-1-butenyl]naphthalene
Wiley ID 1586506