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3-(2-t-Butoxyethyl)decahydroisoquinoline

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

3-(2-t-Butoxyethyl)decahydroisoquinoline
SpectraBase Compound ID GaeznX1Ifxs
InChI InChI=1S/C15H29NO/c1-15(2,3)17-9-8-14-10-12-6-4-5-7-13(12)11-16-14/h12-14,16H,4-11H2,1-3H3
InChIKey GEWXCXKNNKMDHT-UHFFFAOYSA-N
Mol Weight 239.4 g/mol
Molecular Formula C15H29NO
Exact Mass 239.224915 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID GDqoQv0tWBg
Name 3-(2-T-Butoxyethyl)decahydroisoquinoline
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 239.224914557 u
Formula C15H29NO
InChI InChI=1S/C15H29NO/c1-15(2,3)17-9-8-14-10-12-6-4-5-7-13(12)11-16-14/h12-14,16H,4-11H2,1-3H3
InChIKey GEWXCXKNNKMDHT-UHFFFAOYSA-N
Molecular Weight 239.403 g/mol
SMILES C1C2CNC(CCOC(C)(C)C)CC2CCC1
Spectrum/Structure Validation Score (Vapor Phase IR) 0.849078