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1,20:6,3:9,12:14,17-Tetramethenodicyclopenta[a,k]cycloeicosene, 2,7,8,13,18,19-hexahydro-2,2,13,13-tetramethyl-, stereoisomer
SpectraBase Compound ID BKsn0cFU8pI
InChI InChI=1S/C34H32/c1-33(2)29-17-21-5-7-23-11-15-27-28-16-12-24(20-32(28)34(3,4)31(27)19-23)8-6-22-10-14-26(30(33)18-22)25(29)13-9-21/h5,9-16,18-20H,6-8,17H2,1-4H3/b21-5+
InChIKey IQHBROGWYHNVDK-IGCPIRJNSA-N
Mol Weight 440.6 g/mol
Molecular Formula C34H32
Exact Mass 440.250401 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7jNLDl2GUdZ
Name 1,20:6,3:9,12:14,17-Tetramethenodicyclopenta[a,k]cycloeicosene, 2,7,8,13,18,19-hexahydro-2,2,13,13-tetramethyl-, stereoisomer
CAS Registry Number 63837-98-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C34H32
InChI InChI=1S/C34H32/c1-33(2)29-17-21-5-7-23-11-15-27-28-16-12-24(20-32(28)34(3,4)31(27)19-23)8-6-22-10-14-26(30(33)18-22)25(29)13-9-21/h5,9-16,18-20H,6-8,17H2,1-4H3/b21-5+
InChIKey IQHBROGWYHNVDK-IGCPIRJNSA-N
Molecular Weight 440.630 g/mol
SMILES C12=C3c4ccc(cc4C2(C)C)CCc2cc4C(c5cc(C\C=C\(C1)C=C3)ccc5-c4cc2)(C)C
SPLASH splash10-0006-0070900000-73eaaa15e4ae2e03238d
Source of Spectrum K-118-160-27
Synonyms 2,2,15,15-tetramethylheptacyclo[21.3.1.1(3,7).1(10,14).1(16,20).0(4,26).0(13,17)]triaconta-1(27),3,5,7,10(29),11,13,16(28),17,19,23,25-dodecaene 5,5,16,16-Tetramethyl-anti-[2.2](2,7)fluorenophane
Wiley ID 1384985