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Nonacyclo[13.6.6.1(4,10).0(2,14).0(4,12).0(5,9).0(8,12).0(16,21).0(22,27)]hexacosa-2(14),16,18,20,22,24,26-heptaene
SpectraBase Compound ID 7XuaRUkf5o3
InChI InChI=1S/C28H26/c1-2-6-17-16(5-1)25-18-7-3-4-8-19(18)26(17)21-14-28-12-15-11-27(28,13-20(21)25)22-9-10-23(28)24(15)22/h1-8,15,22-26H,9-14H2/t15?,22-,23+,24?,25-,26+,27-,28+
InChIKey WNCIYOQTAPVVMH-UHFFFAOYSA-N
Mol Weight 362.52 g/mol
Molecular Formula C28H26
Exact Mass 362.203451 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9PY6cZco8Fe
Name Nonacyclo[13.6.6.1(4,10).0(2,14).0(4,12).0(5,9).0(8,12).0(16,21).0(22,27)]hexacosa-2(14),16,18,20,22,24,26-heptaene
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Formula C28H26
InChI InChI=1S/C28H26/c1-2-6-17-16(5-1)25-18-7-3-4-8-19(18)26(17)21-14-28-12-15-11-27(28,13-20(21)25)22-9-10-23(28)24(15)22/h1-8,15,22-26H,9-14H2/t15?,22-,23+,24?,25-,26+,27-,28+
InChIKey WNCIYOQTAPVVMH-UHFFFAOYSA-N
Molecular Weight 362.516 g/mol
SMILES [C@@]123[C@@]4([C@]5(C([C@@]1(CC5)[H])C(C3)C4)[H])CC1=C(C2)[C@]2(c3c(cccc3)[C@@]1(c1c2cccc1)[H])[H]
SPLASH splash10-02di-1493000000-ac43bac7a55183a0e5c0
Source of Spectrum F-54-4690-25
Wiley ID 806738