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(3S,5R,8ar)-3-(hex-5-en-1-yl)-5-Propyloctahydroindolizine
SpectraBase Compound ID CVivvml0qOR
InChI InChI=1S/C17H31N/c1-3-5-6-7-10-16-13-14-17-12-8-11-15(9-4-2)18(16)17/h3,15-17H,1,4-14H2,2H3
InChIKey NJUJWPJFTSGFKK-UHFFFAOYSA-N
Mol Weight 249.44 g/mol
Molecular Formula C17H31N
Exact Mass 249.24565 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID KeaPYRpa65
Name (3S,5R,8ar)-3-(hex-5-en-1-yl)-5-Propyloctahydroindolizine
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 249.245650002 u
Formula C17H31N
InChI InChI=1S/C17H31N/c1-3-5-6-7-10-16-13-14-17-12-8-11-15(9-4-2)18(16)17/h3,15-17H,1,4-14H2,2H3
InChIKey NJUJWPJFTSGFKK-UHFFFAOYSA-N
Molecular Weight 249.442 g/mol
SMILES C1CC(N2C(C1)CCC2CCCCC=C)CCC
Spectrum/Structure Validation Score (Vapor Phase IR) 0.926168