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2,2,9,9,14,14,21,21-Octamethyltricyclo[20.2.2.2(10,13)]octacosa-10,12,22,24,25,27-hexaene
SpectraBase Compound ID 5CJCQ4kOjaV
InChI InChI=1S/C36H56/c1-33(2)25-13-9-10-14-26-35(5,6)31-21-23-32(24-22-31)36(7,8)28-16-12-11-15-27-34(3,4)30-19-17-29(33)18-20-30/h17-24H,9-16,25-28H2,1-8H3
InChIKey KHCISCGIORCFBT-UHFFFAOYSA-N
Mol Weight 488.8 g/mol
Molecular Formula C36H56
Exact Mass 488.438202 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID djF4GrgTw
Name 2,2,9,9,14,14,21,21-Octamethyltricyclo[20.2.2.2(10,13)]octacosa-10,12,22,24,25,27-hexaene
Alternate Name(s) 2,2,9,9,14,14,21,21-octamethyltricyclo[20.2.2.2(10,13)]octacosa-1(24),10,12,22,25,27-hexaene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C36H56
InChI InChI=1S/C36H56/c1-33(2)25-13-9-10-14-26-35(5,6)31-21-23-32(24-22-31)36(7,8)28-16-12-11-15-27-34(3,4)30-19-17-29(33)18-20-30/h17-24H,9-16,25-28H2,1-8H3
InChIKey KHCISCGIORCFBT-UHFFFAOYSA-N
Molecular Weight 488.844 g/mol
SMILES C1(c2ccc(C(C)(C)CCCCCCC(c3ccc(C(CCCCCC1)(C)C)cc3)(C)C)cc2)(C)C
SPLASH splash10-052b-0970000000-026f19f3a328ef2b78f6
Source of Spectrum KC-0-1150-45
Wiley ID 785634