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(4b.alpha.,7a.beta.,11b.alpha.,15b.beta.)-11b,15b-Dideuterio-5,6,7,7a,11b,15b-hexhydro-4bH-dibenzo[2,3:4,5]pentaleno[1,6-jk]flurorene
SpectraBase Compound ID HymfAgwN1Yh
InChI InChI=1S/C26H22/c1-3-10-18-16(8-1)22-14-7-15-23-17-9-2-4-11-19(17)25-21-13-6-5-12-20(21)24(18)26(22,23)25/h1-6,8-13,22-25H,7,14-15H2/t22-,23-,24+,25+,26?/m0/s1/i24D,25D
InChIKey IXMHDFDDKMLMPJ-SKDKBSSASA-N
Mol Weight 336.47 g/mol
Molecular Formula C26H20D2
Exact Mass 336.184704 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DcG9nTb70GD
Name (4b.alpha.,7a.beta.,11b.alpha.,15b.beta.)-11b,15b-Dideuterio-5,6,7,7a,11b,15b-hexhydro-4bH-dibenzo[2,3:4,5]pentaleno[1,6-jk]flurorene
Comments Less than 3 mono-isotopic peaks
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Formula C26H20D2
InChI InChI=1S/C26H22/c1-3-10-18-16(8-1)22-14-7-15-23-17-9-2-4-11-19(17)25-21-13-6-5-12-20(21)24(18)26(22,23)25/h1-6,8-13,22-25H,7,14-15H2/t22-,23-,24+,25+,26?/m0/s1/i24D,25D
InChIKey IXMHDFDDKMLMPJ-SKDKBSSASA-N
Molecular Weight 336.474 g/mol
SMILES C123[C@]4(c5ccccc5[C@]3(c3ccccc3[C@@]1(CCC[C@]2(c1ccccc41)[H])[H])[D])[D]
SPLASH splash10-000i-0009000000-2db4bc5f66f36ac98146
Source of Spectrum QE-7-3399-3
Wiley ID 845694