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(2R*,8aS*)-1-Benzyl-2-isopropyl-3-isopropylidene-4-methyl-1,2,3,5,6,7,8,8a-octahydroquinoline
SpectraBase Compound ID 3vNkl2aFytY
InChI InChI=1S/C23H33N/c1-16(2)22-18(5)20-13-9-10-14-21(20)24(23(22)17(3)4)15-19-11-7-6-8-12-19/h6-8,11-12,17,21,23H,9-10,13-15H2,1-5H3/t21-,23+/m0/s1
InChIKey QSEMVLIAOGWQNI-JTHBVZDNSA-N
Mol Weight 323.5 g/mol
Molecular Formula C23H33N
Exact Mass 323.2613 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4QD9ldtHB4f
Name (2R*,8aS*)-1-Benzyl-2-isopropyl-3-isopropylidene-4-methyl-1,2,3,5,6,7,8,8a-octahydroquinoline
Alternate Name(s) (2R,8aS)-1-benzyl-2-isopropyl-4-methyl-3-(1-methylethylidene)-1,2,3,5,6,7,8,8a-octahydroquinoline
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H33N
InChI InChI=1S/C23H33N/c1-16(2)22-18(5)20-13-9-10-14-21(20)24(23(22)17(3)4)15-19-11-7-6-8-12-19/h6-8,11-12,17,21,23H,9-10,13-15H2,1-5H3/t21-,23+/m0/s1
InChIKey QSEMVLIAOGWQNI-JTHBVZDNSA-N
Molecular Weight 323.524 g/mol
SMILES [C@]1(N([C@@]2(C(=C(C1=C(C)C)C)CCCC2)[H])Cc1ccccc1)(C(C)C)[H]
SPLASH splash10-001i-0090000000-1d04c6b1ed7cb4274dff
Source of Spectrum F-68-7851-30
Wiley ID 1573486