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2-propyl-5-[4-[4-(4-propylcyclohexyl)phenyl]phenyl]-1,2,3,3a,4,5,6,6a-octahydropentalene
SpectraBase Compound ID CucA2QriSGH
InChI InChI=1S/C32H44/c1-3-5-23-7-9-25(10-8-23)26-11-13-27(14-12-26)28-15-17-29(18-16-28)32-21-30-19-24(6-4-2)20-31(30)22-32/h11-18,23-25,30-32H,3-10,19-22H2,1-2H3
InChIKey IZBNOOPOIIHVKL-UHFFFAOYSA-N
Mol Weight 428.7 g/mol
Molecular Formula C32H44
Exact Mass 428.344301 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3k5uHbsOTGu
Name 2-propyl-5-[4-[4-(4-propylcyclohexyl)phenyl]phenyl]-1,2,3,3a,4,5,6,6a-octahydropentalene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C32H44
InChI InChI=1S/C32H44/c1-3-5-23-7-9-25(10-8-23)26-11-13-27(14-12-26)28-15-17-29(18-16-28)32-21-30-19-24(6-4-2)20-31(30)22-32/h11-18,23-25,30-32H,3-10,19-22H2,1-2H3
InChIKey IZBNOOPOIIHVKL-UHFFFAOYSA-N
Ionization Type EI
Molecular Weight 428.704 g/mol
SMILES C1C(CC2C1CC(C2)c1ccc(cc1)-c1ccc(cc1)C1CCC(CC1)CCC)CCC
SPLASH splash10-0a4i-0901100000-3981c79b059f57e86940
Source of Spectrum CN102875417A
Wiley ID 1847079