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2-Methyl-3'-methylene-spiro[3,4-dihydroisoquinoline-1,1'-cycloheptane]
SpectraBase Compound ID 6Sa8cfQ7MJ1
InChI InChI=1S/C17H23N/c1-14-7-5-6-11-17(13-14)16-9-4-3-8-15(16)10-12-18(17)2/h3-4,8-9H,1,5-7,10-13H2,2H3
InChIKey LKXOAVQCIIHRFZ-UHFFFAOYSA-N
Mol Weight 241.38 g/mol
Molecular Formula C17H23N
Exact Mass 241.18305 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID FnvD3wUy2aG
Name 2-Methyl-3'-methylene-spiro[3,4-dihydroisoquinoline-1,1'-cycloheptane]
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 241.183049745 u
Formula C17H23N
InChI InChI=1S/C17H23N/c1-14-7-5-6-11-17(13-14)16-9-4-3-8-15(16)10-12-18(17)2/h3-4,8-9H,1,5-7,10-13H2,2H3
InChIKey LKXOAVQCIIHRFZ-UHFFFAOYSA-N
Molecular Weight 241.378 g/mol
SMILES C12(N(CCC3=C2C=CC=C3)C)CC(=C)CCCC1
Spectrum/Structure Validation Score (Vapor Phase IR) 0.899697