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(2S,4aS,5R,8aR)-1-Benzyl-5-methyl-2-propyldecahydroquinoline

View entire compound with spectra: 1 MS (GC)

(2S,4aS,5R,8aR)-1-Benzyl-5-methyl-2-propyldecahydroquinoline
SpectraBase Compound ID 3w70KtjPDWf
InChI InChI=1S/C20H31N/c1-3-8-18-13-14-19-16(2)9-7-12-20(19)21(18)15-17-10-5-4-6-11-17/h4-6,10-11,16,18-20H,3,7-9,12-15H2,1-2H3/t16-,18+,19+,20-/m1/s1
InChIKey QLNLLKVCOCBYLH-BTHPGYMESA-N
Mol Weight 285.47 g/mol
Molecular Formula C20H31N
Exact Mass 285.24565 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GMkqIMRNshY
Name (2S,4aS,5R,8aR)-1-Benzyl-5-methyl-2-propyldecahydroquinoline
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H31N
InChI InChI=1S/C20H31N/c1-3-8-18-13-14-19-16(2)9-7-12-20(19)21(18)15-17-10-5-4-6-11-17/h4-6,10-11,16,18-20H,3,7-9,12-15H2,1-2H3/t16-,18+,19+,20-/m1/s1
InChIKey QLNLLKVCOCBYLH-BTHPGYMESA-N
Molecular Weight 285.475 g/mol
SMILES [C@@]1(N([C@@]2(CCC[C@]([C@@]2(CC1)[H])(C)[H])[H])Cc1ccccc1)(CCC)[H]
SPLASH splash10-0006-5090000000-8d7088659b2a81175882
Source of Spectrum KC-0-1122-37
Wiley ID 785668