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17,19-Dimethyl-hexacyclo[28.2.2.2(3,6).1(9,13).1(16,20).1(23,27)]nonatriconta[3,5,9,11,13(37),16,18,20(36),23,25,27(35),30,32,33,38]pentadecaene
SpectraBase Compound ID 1RQKop98Yfw
InChI InChI=1S/C41H42/c1-30-25-31(2)41-24-22-37-8-4-6-35(27-37)16-10-33-13-19-39(20-14-33)28-38-17-11-32(12-18-38)9-15-34-5-3-7-36(26-34)21-23-40(30)29-41/h3-8,11-14,17-20,25-27,29H,9-10,15-16,21-24,28H2,1-2H3
InChIKey DAZXCILNUMTIBJ-UHFFFAOYSA-N
Mol Weight 534.8 g/mol
Molecular Formula C41H42
Exact Mass 534.328651 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CRiJMIB2khp
Name 17,19-Dimethyl-hexacyclo[28.2.2.2(3,6).1(9,13).1(16,20).1(23,27)]nonatriconta[3,5,9,11,13(37),16,18,20(36),23,25,27(35),30,32,33,38]pentadecaene
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Formula C41H42
InChI InChI=1S/C41H42/c1-30-25-31(2)41-24-22-37-8-4-6-35(27-37)16-10-33-13-19-39(20-14-33)28-38-17-11-32(12-18-38)9-15-34-5-3-7-36(26-34)21-23-40(30)29-41/h3-8,11-14,17-20,25-27,29H,9-10,15-16,21-24,28H2,1-2H3
InChIKey DAZXCILNUMTIBJ-UHFFFAOYSA-N
Literature Reference DOI 10.1002_1521-3897(200009)342_7_642
Molecular Weight 534.787 g/mol
SMILES C1Cc2ccc(cc2)Cc2ccc(cc2)CCc2cc(ccc2)CCc2c(cc(c(CCc3cccc1c3)c2)C)C
SPLASH splash10-05o1-2900030000-eeef677c67343717c1b2
Source of Spectrum JF-342-651-6
Wiley ID 1767063