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Butyric acid, 4-phenyl-, nonyl ester

View entire compound with spectra: 1 NMR, and 1 FTIR

Butyric acid, 4-phenyl-, nonyl ester
SpectraBase Compound ID 7aQ2DLDYPAi
InChI InChI=1S/C19H30O2/c1-2-3-4-5-6-7-11-17-21-19(20)16-12-15-18-13-9-8-10-14-18/h8-10,13-14H,2-7,11-12,15-17H2,1H3
InChIKey OUVDUDLJCSORPT-UHFFFAOYSA-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 94LlpJMu5XS
Name Butyric acid, 4-phenyl-, nonyl ester
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/c1-2-3-4-5-6-7-11-17-21-19(20)16-12-15-18-13-9-8-10-14-18/h8-10,13-14H,2-7,11-12,15-17H2,1H3
InChIKey OUVDUDLJCSORPT-UHFFFAOYSA-N
SMILES C(CCCC=1C=CC=CC1)(OCCCCCCCCC)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.946716