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Succinic acid, dodec-2-en-1-yl non-3-en-1-yl ester

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

Succinic acid, dodec-2-en-1-yl non-3-en-1-yl ester
SpectraBase Compound ID DLaPhBYZsds
InChI InChI=1S/C25H44O4/c1-3-5-7-9-11-12-13-15-17-19-23-29-25(27)21-20-24(26)28-22-18-16-14-10-8-6-4-2/h14,16-17,19H,3-13,15,18,20-23H2,1-2H3/b16-14+,19-17+
InChIKey FDBVSTKBUADVJM-VCDHSRODSA-N
Mol Weight 408.6 g/mol
Molecular Formula C25H44O4
Exact Mass 408.32396 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID LWDq4dw4dcR
Name Succinic acid, dodec-2-en-1-yl non-3-en-1-yl ester
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 408.323959893 u
Formula C25H44O4
InChI InChI=1S/C25H44O4/c1-3-5-7-9-11-12-13-15-17-19-23-29-25(27)21-20-24(26)28-22-18-16-14-10-8-6-4-2/h14,16-17,19H,3-13,15,18,20-23H2,1-2H3/b16-14+,19-17+
InChIKey FDBVSTKBUADVJM-VCDHSRODSA-N
Molecular Weight 408.623 g/mol
SMILES C(CC(OC\C=C\CCCCCCCCC)=O)C(OCC\C=C\CCCCC)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.90209