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(2R,3R,5S)-5-Isopropenyl-3-isopropyl-2-[2-(6-methoxy-3,4-dihydro-2H-naphthalen-1-ylidene)ethyl]-2-methylcyclohexanone
SpectraBase Compound ID AAgnEQtOP0q
InChI InChI=1S/C26H36O2/c1-17(2)21-15-24(18(3)4)26(5,25(27)16-21)13-12-19-8-7-9-20-14-22(28-6)10-11-23(19)20/h10-12,14,18,21,24H,1,7-9,13,15-16H2,2-6H3/b19-12+/t21-,24+,26+/m0/s1
InChIKey NNRKXOZMWHMZHJ-QNVQTXRRSA-N
Mol Weight 380.6 g/mol
Molecular Formula C26H36O2
Exact Mass 380.27153 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DclHDfPPCx4
Name (2R,3R,5S)-5-Isopropenyl-3-isopropyl-2-[2-(6-methoxy-3,4-dihydro-2H-naphthalen-1-ylidene)ethyl]-2-methylcyclohexanone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C26H36O2
InChI InChI=1S/C26H36O2/c1-17(2)21-15-24(18(3)4)26(5,25(27)16-21)13-12-19-8-7-9-20-14-22(28-6)10-11-23(19)20/h10-12,14,18,21,24H,1,7-9,13,15-16H2,2-6H3/b19-12+/t21-,24+,26+/m0/s1
InChIKey NNRKXOZMWHMZHJ-QNVQTXRRSA-N
Molecular Weight 380.572 g/mol
SMILES [C@@]1([C@](C[C@@](CC1=O)(C(=C)C)[H])(C(C)C)[H])(C\C=C\1c2c(cc(cc2)OC)CCC1)C
SPLASH splash10-000i-0900000000-996a17fc7b2310c11048
Source of Spectrum F-62-1739-61
Synonyms (2R,3R,5S)-5-isopropenyl-3-isopropyl-2-[(2E)-2-(6-methoxy-3,4-dihydro-1(2H)-naphthalenylidene)ethyl]-2-methylcyclohexanone 5-Isopropenyl-3-isopropyl-2-[2-(6-methoxy-3,4-dihydro-2H-naphthalen-1-ylidene)ethyl]-2-methylcyclohexanone
Wiley ID 1632293