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Biphenylene, dodecahydro-4a,4b-diphenyl-, (4a.alpha.,4b.beta.,8a.beta.,8b.alpha.)-
SpectraBase Compound ID 7QXzlEVAwE3
InChI InChI=1S/C24H28/c1-3-11-19(12-4-1)23-17-9-7-15-21(23)22-16-8-10-18-24(22,23)20-13-5-2-6-14-20/h1-6,11-14,21-22H,7-10,15-18H2/t21-,22-,23+,24+/m1/s1
InChIKey LPUHZRRLTWWWTG-LWSSLDFYSA-N
Mol Weight 316.49 g/mol
Molecular Formula C24H28
Exact Mass 316.219101 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IiPy2xIKnyp
Name Biphenylene, dodecahydro-4a,4b-diphenyl-, (4a.alpha.,4b.beta.,8a.beta.,8b.alpha.)-
CAS Registry Number 72227-95-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H28
InChI InChI=1S/C24H28/c1-3-11-19(12-4-1)23-17-9-7-15-21(23)22-16-8-10-18-24(22,23)20-13-5-2-6-14-20/h1-6,11-14,21-22H,7-10,15-18H2/t21-,22-,23+,24+/m1/s1
InChIKey LPUHZRRLTWWWTG-LWSSLDFYSA-N
Molecular Weight 316.488 g/mol
SMILES [C@@]12([C@]3(c4ccccc4)CCCC[C@@]3([C@]1(CCCC2)[H])[H])c1ccccc1
SPLASH splash10-052u-4691000000-286bc9f64a2a70fd0a3e
Source of Spectrum C-101-6388-0
Synonyms (4aR,4bR,8aR,8bR)-4a,4b-diphenyldodecahydrobiphenylene Anti 1.beta.-phenylbenzo[2,3]bicyclo[8.4.0.0(4,9)]tetradecane
Wiley ID 1317427