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3-Butyl-5-(hex-5-en-1-yl)hexahydro-1H-pyrrolizine

View entire compound with spectra: 1 NMR, and 1 FTIR

3-Butyl-5-(hex-5-en-1-yl)hexahydro-1H-pyrrolizine
SpectraBase Compound ID FaVoBUEW2lW
InChI InChI=1S/C17H31N/c1-3-5-7-8-10-16-12-14-17-13-11-15(18(16)17)9-6-4-2/h3,15-17H,1,4-14H2,2H3
InChIKey AVCHFMDYFWBBRU-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 8MSbUpGRkda
Name 3-Butyl-5-(hex-5-en-1-yl)hexahydro-1H-pyrrolizine
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/c1-3-5-7-8-10-16-12-14-17-13-11-15(18(16)17)9-6-4-2/h3,15-17H,1,4-14H2,2H3
InChIKey AVCHFMDYFWBBRU-UHFFFAOYSA-N
Molecular Weight 249.442 g/mol
SMILES C1C(N2C(CCC2C1)CCCC)CCCCC=C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.951864