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(2S,4aR,5RS,8aR)-1-Benzoyl-4a-hydroxy-5-methyl-2-propyldecahydroquinolin-6-one
SpectraBase Compound ID HRqtQBOTQ5z
InChI InChI=1S/C20H27NO3/c1-3-7-16-12-13-20(24)14(2)17(22)10-11-18(20)21(16)19(23)15-8-5-4-6-9-15/h4-6,8-9,14,16,18,24H,3,7,10-13H2,1-2H3/t14?,16-,18+,20+/m0/s1
InChIKey PPNNEIDLLFBITE-XLIRACIQSA-N
Mol Weight 329.44 g/mol
Molecular Formula C20H27NO3
Exact Mass 329.199094 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HdcerezQu43
Name (2S,4aR,5RS,8aR)-1-Benzoyl-4a-hydroxy-5-methyl-2-propyldecahydroquinolin-6-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H27NO3
InChI InChI=1S/C20H27NO3/c1-3-7-16-12-13-20(24)14(2)17(22)10-11-18(20)21(16)19(23)15-8-5-4-6-9-15/h4-6,8-9,14,16,18,24H,3,7,10-13H2,1-2H3/t14?,16-,18+,20+/m0/s1
InChIKey PPNNEIDLLFBITE-XLIRACIQSA-N
Molecular Weight 329.440 g/mol
SMILES O[C@]12[C@](N(C(=O)c3ccccc3)[C@](CC1)(CCC)[H])(CCC(=O)C2C)[H]
SPLASH splash10-0a4i-3910000000-23db364adb5ec579e787
Source of Spectrum KC-0-1122-32
Synonyms (2S,4aR,8aR)-1-benzoyl-4a-hydroxy-5-methyl-2-propyloctahydro-6(2H)-quinolinone
Wiley ID 785671