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trans-Tetradecahydro-7a,7b-diphenyl-cyclobuta[1,2 ; 3,4]dicyclononene
SpectraBase Compound ID mgT1iMDZIi
InChI InChI=1S/C30H36/c1-3-13-21-27-28-22-14-4-2-6-16-24-30(28,26-19-11-8-12-20-26)29(27,23-15-5-1)25-17-9-7-10-18-25/h7-12,17-22H,1-6,13-16,23-24H2/b27-21-,28-22-/t29-,30-/m0/s1
InChIKey FURDXVQKRLQXCB-WPTRWPBZSA-N
Mol Weight 396.6 g/mol
Molecular Formula C30H36
Exact Mass 396.281701 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7MmR3DPx7PI
Name trans-Tetradecahydro-7a,7b-diphenyl-cyclobuta[1,2 ; 3,4]dicyclononene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C30H36
InChI InChI=1S/C30H36/c1-3-13-21-27-28-22-14-4-2-6-16-24-30(28,26-19-11-8-12-20-26)29(27,23-15-5-1)25-17-9-7-10-18-25/h7-12,17-22H,1-6,13-16,23-24H2/b27-21-,28-22-/t29-,30-/m0/s1
InChIKey FURDXVQKRLQXCB-WPTRWPBZSA-N
Molecular Weight 396.618 g/mol
SMILES [C@@]12([C@]3(c4ccccc4)CCCCCC\C=C/3\C1=C/CCCCCC2)c1ccccc1
SPLASH splash10-0007-5906000000-e36c3b66d05deba4fc70
Source of Spectrum U-1997-1795-0
Synonyms (14aS,14bS)-14a,14b-diphenyl-1,2,3,4,5,6,9,10,11,12,13,14,14a,14b-tetradecahydrocyclonona[3,4]cyclobuta[1,2-a]cyclononene
Wiley ID 770056