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Glutaric acid, di(farnesyl) ester

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

Glutaric acid, di(farnesyl) ester
SpectraBase Compound ID 1b2BYvghsNx
InChI InChI=1S/C35H56O4/c1-28(2)14-9-16-30(5)18-11-20-32(7)24-26-38-34(36)22-13-23-35(37)39-27-25-33(8)21-12-19-31(6)17-10-15-29(3)4/h14-15,18-19,24-25H,9-13,16-17,20-23,26-27H2,1-8H3/b30-18+,31-19+,32-24+,33-25+
InChIKey PRYOXVWTLUIWTF-XFASTTODSA-N
Mol Weight 540.8 g/mol
Molecular Formula C35H56O4
Exact Mass 540.41786 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 7IiJed0lcWC
Name Glutaric acid, di(farnesyl) ester
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 540.417860279 u
Formula C35H56O4
InChI InChI=1S/C35H56O4/c1-28(2)14-9-16-30(5)18-11-20-32(7)24-26-38-34(36)22-13-23-35(37)39-27-25-33(8)21-12-19-31(6)17-10-15-29(3)4/h14-15,18-19,24-25H,9-13,16-17,20-23,26-27H2,1-8H3/b30-18+,31-19+,32-24+,33-25+
InChIKey PRYOXVWTLUIWTF-XFASTTODSA-N
Molecular Weight 540.829 g/mol
SMILES C(CCC(OC\C=C/(C)CC\C=C/(C)CCC=C(C)C)=O)C(OC\C=C\(CC\C=C\(CCC=C(C)C)C)C)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.987571