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2-Cyanomethyl-2-methyl-8-methoxy-1,2,3,4-tetrahydroquinoline

View entire compound with spectra: 1 FTIR

2-Cyanomethyl-2-methyl-8-methoxy-1,2,3,4-tetrahydroquinoline
SpectraBase Compound ID FJjrdA2rTEV
InChI InChI=1S/C13H16N2O/c1-13(8-9-14)7-6-10-4-3-5-11(16-2)12(10)15-13/h3-5,15H,6-8H2,1-2H3
InChIKey NSVPTTKFCNVNRT-UHFFFAOYSA-N
Mol Weight 216.28 g/mol
Molecular Formula C13H16N2O
Exact Mass 216.126263 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 1kdIJQx3EWQ
Name 2-Cyanomethyl-2-methyl-8-methoxy-1,2,3,4-tetrahydroquinoline
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 216.126263142 u
Formula C13H16N2O
InChI InChI=1S/C13H16N2O/c1-13(8-9-14)7-6-10-4-3-5-11(16-2)12(10)15-13/h3-5,15H,6-8H2,1-2H3
InChIKey NSVPTTKFCNVNRT-UHFFFAOYSA-N
Molecular Weight 216.284 g/mol
SMILES C12=CC=CC(=C2NC(CC1)(C)CC#N)OC
Spectrum/Structure Validation Score (Vapor Phase IR) 0.86591