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Succinic acid, 3-methylbut-2-yl hex-5-en-1-yl ester

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

Succinic acid, 3-methylbut-2-yl hex-5-en-1-yl ester
SpectraBase Compound ID 9wGKVkgBnhO
InChI InChI=1S/C15H26O4/c1-5-6-7-8-11-18-14(16)9-10-15(17)19-13(4)12(2)3/h5,12-13H,1,6-11H2,2-4H3
InChIKey ACWRYCMWIJZJKN-UHFFFAOYSA-N
Mol Weight 270.37 g/mol
Molecular Formula C15H26O4
Exact Mass 270.183109 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 7Br0kgAnMM7
Name Succinic acid, 3-methylbut-2-yl hex-5-en-1-yl ester
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 270.183109313 u
Formula C15H26O4
InChI InChI=1S/C15H26O4/c1-5-6-7-8-11-18-14(16)9-10-15(17)19-13(4)12(2)3/h5,12-13H,1,6-11H2,2-4H3
InChIKey ACWRYCMWIJZJKN-UHFFFAOYSA-N
Molecular Weight 270.369 g/mol
SMILES C(CC(OC(C(C)C)C)=O)C(OCCCCC=C)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.914613