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2-(2-Methylpropyl)-3,4-dihydro-1H-isoquinoline

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

2-(2-Methylpropyl)-3,4-dihydro-1H-isoquinoline
SpectraBase Compound ID CcLh9Ah3Ruu
InChI InChI=1S/C13H19N/c1-11(2)9-14-8-7-12-5-3-4-6-13(12)10-14/h3-6,11H,7-10H2,1-2H3
InChIKey MCKFHPKZHOUJQZ-UHFFFAOYSA-N
Mol Weight 189.3 g/mol
Molecular Formula C13H19N
Exact Mass 189.15175 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 1pU6hQ90sEA
Name 2-(2-Methylpropyl)-3,4-dihydro-1H-isoquinoline
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 189.151749616 u
Formula C13H19N
InChI InChI=1S/C13H19N/c1-11(2)9-14-8-7-12-5-3-4-6-13(12)10-14/h3-6,11H,7-10H2,1-2H3
InChIKey MCKFHPKZHOUJQZ-UHFFFAOYSA-N
Molecular Weight 189.302 g/mol
SMILES C1N(CCC=2C=CC=CC12)CC(C)C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.928602