For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.

(1R*,2S*,3R*)-3-isopropyl-2-methoxy-1-(phenylthiomethyl)hexahydroindolizin-5(1H)- one

View entire compound with spectra: 2 MS (GC)

(1R*,2S*,3R*)-3-isopropyl-2-methoxy-1-(phenylthiomethyl)hexahydroindolizin-5(1H)- one
SpectraBase Compound ID 8Tow4sxe9f7
InChI InChI=1S/C19H27NO2S/c1-13(2)18-19(22-3)15(12-23-14-8-5-4-6-9-14)16-10-7-11-17(21)20(16)18/h4-6,8-9,13,15-16,18-19H,7,10-12H2,1-3H3/t15-,16?,18-,19+/m1/s1
InChIKey XNKHNXOQSXFLKC-VBZNHOPUSA-N
Mol Weight 333.49 g/mol
Molecular Formula C19H27NO2S
Exact Mass 333.17625 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 5NNmZEYZGka
Name (1R*,2S*,3R*)-3-isopropyl-2-methoxy-1-(phenylthiomethyl)hexahydroindolizin-5(1H)- one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H27NO2S
InChI InChI=1S/C19H27NO2S/c1-13(2)18-19(22-3)15(12-23-14-8-5-4-6-9-14)16-10-7-11-17(21)20(16)18/h4-6,8-9,13,15-16,18-19H,7,10-12H2,1-3H3/t15-,16?,18-,19+/m1/s1
InChIKey XNKHNXOQSXFLKC-VBZNHOPUSA-N
Literature Reference DOI 10.1021/ol702017t
Molecular Weight 333.490 g/mol
SMILES [C@@]1([C@@](OC)([C@@](C2N1C(CCC2)=O)(CSc1ccccc1)[H])[H])(C(C)C)[H]
SPLASH splash10-0012-9100000000-6e3d276d1b1afe404a69
Source of Spectrum A1-9-4375/SM15-majordiastereomer18
Synonyms (1R,2S,3R)-3-isopropyl-2-methoxy-1-((phenylthio)methyl)hexahydroindolizin-5(1H)-one
Wiley ID 1758709