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3-cyclopentyl-2-(isopropylmethyl)-3-(hexahydropyridyl)bicyclo[3.3.0]octane
SpectraBase Compound ID LS5aOm9Ot8N
InChI InChI=1S/C22H39N/c1-17(2)15-21-20-12-8-9-18(20)16-22(21,19-10-4-5-11-19)23-13-6-3-7-14-23/h17-21H,3-16H2,1-2H3/t18-,20-,21+,22?/m1/s1
InChIKey BQOCNKWUANAGJR-VMSMKEMKSA-N
Mol Weight 317.6 g/mol
Molecular Formula C22H39N
Exact Mass 317.30825 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID sK39ol9hg
Name 3-cyclopentyl-2-(isopropylmethyl)-3-(hexahydropyridyl)bicyclo[3.3.0]octane
Alternate Name(s) 1-((1S,3aR,6aR)-2-Cyclopentyl-1-isobutyl-octahydro-pentalen-2-yl)-piperidine 2-(2-cyclopentyl-1-isobutyloctahydro-2-pentalenyl)piperidine 1-[(1S,3aR,6aR)-2-cyclopentyl-1-(2-methylpropyl)-3,3a,4,5,6,6a-hexahydro-1H-pentalen-2-yl]piperidine
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Formula C22H39N
InChI InChI=1S/C22H39N/c1-17(2)15-21-20-12-8-9-18(20)16-22(21,19-10-4-5-11-19)23-13-6-3-7-14-23/h17-21H,3-16H2,1-2H3/t18-,20-,21+,22?/m1/s1
InChIKey BQOCNKWUANAGJR-VMSMKEMKSA-N
Molecular Weight 317.561 g/mol
SMILES C1([C@]([C@@]2(CCC[C@@]2(C1)[H])[H])(CC(C)C)[H])(N1CCCCC1)C1CCCC1
SPLASH splash10-004j-0790000000-e69cda25ce22dd2af8f3
Source of Spectrum J-63-8513-20
Wiley ID 1317911