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Hexacyclo[11.6.6.0(14,19).0(20,25)]pentaeicosane-3,5(10),6,8,11,14(19),15,17,19,20(25),21,23-dodecaene
SpectraBase Compound ID 3xTxktFil5S
InChI InChI=1S/C25H18/c1-2-8-17-14-23-18(13-16(17)7-1)15-24-19-9-3-5-11-21(19)25(23)22-12-6-4-10-20(22)24/h1-14,24-25H,15H2/t24-,25+
InChIKey JHAVJQSTJMVZLB-PLQXJYEYSA-N
Mol Weight 318.42 g/mol
Molecular Formula C25H18
Exact Mass 318.140851 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IH63O398752
Name Hexacyclo[11.6.6.0(14,19).0(20,25)]pentaeicosane-3,5(10),6,8,11,14(19),15,17,19,20(25),21,23-dodecaene
Comments Less than 3 mono-isotopic peaks
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Formula C25H18
InChI InChI=1S/C25H18/c1-2-8-17-14-23-18(13-16(17)7-1)15-24-19-9-3-5-11-21(19)25(23)22-12-6-4-10-20(22)24/h1-14,24-25H,15H2/t24-,25+
InChIKey JHAVJQSTJMVZLB-PLQXJYEYSA-N
Molecular Weight 318.419 g/mol
SMILES [C@]12(c3c(C[C@](c4c2cccc4)(c2c1cccc2)[H])cc1c(c3)cccc1)[H]
SPLASH splash10-014i-0009000000-838a68a5bcdb3ec058a9
Source of Spectrum H1-48-1774-8
Synonyms hexacyclo[11.6.6.0(2,11).0(4,9).0(14,19).0(20,25)]pentacosa-2(11),3,5,7,9,14,16,18,20,22,24-undecaene
Wiley ID 816505