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2-Butyl-5-((E)-hept-1-enyl)-1,3-dimethoxybenzene

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

2-Butyl-5-((E)-hept-1-enyl)-1,3-dimethoxybenzene
SpectraBase Compound ID FgPLoiPFnwX
InChI InChI=1S/C19H30O2/c1-5-7-9-10-11-12-16-14-18(20-3)17(13-8-6-2)19(15-16)21-4/h11-12,14-15H,5-10,13H2,1-4H3/b12-11+
InChIKey WETYGMIKZBQELW-VAWYXSNFSA-N
Mol Weight 290.45 g/mol
Molecular Formula C19H30O2
Exact Mass 290.22458 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 3farP9G5vDH
Name 2-Butyl-5-((E)-hept-1-enyl)-1,3-dimethoxybenzene
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 290.224580204 u
Formula C19H30O2
InChI InChI=1S/C19H30O2/c1-5-7-9-10-11-12-16-14-18(20-3)17(13-8-6-2)19(15-16)21-4/h11-12,14-15H,5-10,13H2,1-4H3/b12-11+
InChIKey WETYGMIKZBQELW-VAWYXSNFSA-N
SMILES C=1(C(=CC(=CC1OC)\C=C\CCCCC)OC)CCCC
Spectrum/Structure Validation Score (Vapor Phase IR) 0.828903