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3-(3,7-Dimethyl-octa-2,6-dienyl)-4-hydroxy-benzaldehyde

View entire compound with spectra: 1 NMR, 1 FTIR, and 2 MS (GC)

3-(3,7-Dimethyl-octa-2,6-dienyl)-4-hydroxy-benzaldehyde
SpectraBase Compound ID KolgYipASRp
InChI InChI=1S/C17H22O2/c1-13(2)5-4-6-14(3)7-9-16-11-15(12-18)8-10-17(16)19/h5,7-8,10-12,19H,4,6,9H2,1-3H3/b14-7+
InChIKey JCSFPBPIAABCRH-VGOFMYFVSA-N
Mol Weight 258.36 g/mol
Molecular Formula C17H22O2
Exact Mass 258.16198 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID DBkumPTnuMd
Name 3-(3,7-Dimethyl-octa-2,6-dienyl)-4-hydroxy-benzaldehyde
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 258.161979946 u
Formula C17H22O2
InChI InChI=1S/C17H22O2/c1-13(2)5-4-6-14(3)7-9-16-11-15(12-18)8-10-17(16)19/h5,7-8,10-12,19H,4,6,9H2,1-3H3/b14-7+
InChIKey JCSFPBPIAABCRH-VGOFMYFVSA-N
Molecular Weight 258.361 g/mol
SMILES C1=C(O)C(C\C=C\(CCC=C(C)C)C)=CC(=C1)C=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.896213