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1,20:6,3:9,12:14,17-Tetramethenodicyclopenta[a,k]cycloeicosene, 2,7,8,13,18,19-hexahydro-2,13-dimethyl-, stereoisomer
SpectraBase Compound ID 863mBy3wqDm
InChI InChI=1S/C32H28/c1-19-29-15-21-3-5-23-9-13-27-28-14-10-24(18-32(28)20(2)31(27)17-23)6-4-22-8-12-26(30(19)16-22)25(29)11-7-21/h7-20H,3-6H2,1-2H3
InChIKey AXOFBFJXMOLTER-UHFFFAOYSA-N
Mol Weight 412.6 g/mol
Molecular Formula C32H28
Exact Mass 412.219101 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID C8xJCwHALss
Name 1,20:6,3:9,12:14,17-Tetramethenodicyclopenta[a,k]cycloeicosene, 2,7,8,13,18,19-hexahydro-2,13-dimethyl-, stereoisomer
CAS Registry Number 63837-97-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C32H28
InChI InChI=1S/C32H28/c1-19-29-15-21-3-5-23-9-13-27-28-14-10-24(18-32(28)20(2)31(27)17-23)6-4-22-8-12-26(30(19)16-22)25(29)11-7-21/h7-20H,3-6H2,1-2H3
InChIKey AXOFBFJXMOLTER-UHFFFAOYSA-N
Molecular Weight 412.576 g/mol
SMILES c12c3-c4ccc(cc4C2C)CCc2cc4C(c5cc(CCc(c1)cc3)ccc5-c4cc2)C
SPLASH splash10-08fr-0250900000-85d1fd608143008a5301
Source of Spectrum K-118-160-26
Synonyms 2,15-dimethylheptacyclo[21.3.1.1(3,7).1(10,14).1(16,20).0(4,26).0(13,17)]triaconta-1(27),3(30),4,6,10(29),11,13,16(28),17,19,23,25-dodecaene exo-5,exo-16-dimethyl-anti-[2,2](2,7)fluorenophane
Wiley ID 1374917