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(5R*,8S*,8as*)-8-Hydroxymethyl-5-([(Z)-hept-4-enyl)octahydroindolizine

View entire compound with spectra: 1 NMR, 1 FTIR, and 2 MS (GC)

(5R*,8S*,8as*)-8-Hydroxymethyl-5-([(Z)-hept-4-enyl)octahydroindolizine
SpectraBase Compound ID 8AEThrIkUQj
InChI InChI=1S/C16H29NO/c1-2-3-4-5-6-8-15-11-10-14(13-18)16-9-7-12-17(15)16/h3-4,14-16,18H,2,5-13H2,1H3/b4-3+/t14-,15-,16+/m1/s1
InChIKey GSWMKSQVGCHVQY-OUUQNZETSA-N
Mol Weight 251.41 g/mol
Molecular Formula C16H29NO
Exact Mass 251.224915 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FrMbhUFtKl3
Name (5R*,8S*,8as*)-8-Hydroxymethyl-5-([(Z)-hept-4-enyl)octahydroindolizine
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 251.224914557 u
Formula C16H29NO
InChI InChI=1S/C16H29NO/c1-2-3-4-5-6-8-15-11-10-14(13-18)16-9-7-12-17(15)16/h3-4,14-16,18H,2,5-13H2,1H3/b4-3+/t14-,15-,16+/m1/s1
InChIKey GSWMKSQVGCHVQY-OUUQNZETSA-N
Molecular Weight 251.414 g/mol
SMILES [C@@]12(N([C@@](CC[C@@]2(CO)[H])(CCC\C=C\CC)[H])CCC1)[H]