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Methyl (2S,3S,5S,8aR)-1-Benzoyl-3-hydroxy-2-methyl-1,2,3,5,6,7,8,8a-octahydro-5-quinolinecarboxylate
SpectraBase Compound ID Kg35LLbJHke
InChI InChI=1S/C19H23NO4/c1-12-17(21)11-15-14(19(23)24-2)9-6-10-16(15)20(12)18(22)13-7-4-3-5-8-13/h3-5,7-8,11-12,14,16-17,21H,6,9-10H2,1-2H3/t12-,14-,16+,17-/m0/s1
InChIKey SXTOGKTXBWADKK-SDNTUTLCSA-N
Mol Weight 329.4 g/mol
Molecular Formula C19H23NO4
Exact Mass 329.162708 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID C7sHzjgIqMs
Name Methyl (2S,3S,5S,8aR)-1-Benzoyl-3-hydroxy-2-methyl-1,2,3,5,6,7,8,8a-octahydro-5-quinolinecarboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H23NO4
InChI InChI=1S/C19H23NO4/c1-12-17(21)11-15-14(19(23)24-2)9-6-10-16(15)20(12)18(22)13-7-4-3-5-8-13/h3-5,7-8,11-12,14,16-17,21H,6,9-10H2,1-2H3/t12-,14-,16+,17-/m0/s1
InChIKey SXTOGKTXBWADKK-SDNTUTLCSA-N
Molecular Weight 329.396 g/mol
SMILES O[C@@]1([C@@](N([C@]2(C(=C1)[C@](CCC2)(C(=O)OC)[H])[H])C(c1ccccc1)=O)(C)[H])[H]
SPLASH splash10-0f6t-0961000000-cb6853d6bbcde2e5c053
Source of Spectrum J-66-3345-45
Wiley ID 1535149