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Succinic acid, 2-methylpent-3-yl but-3-en-1-yl ester

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

Succinic acid, 2-methylpent-3-yl but-3-en-1-yl ester
SpectraBase Compound ID cQCD0yFpzU
InChI InChI=1S/C14H24O4/c1-5-7-10-17-13(15)8-9-14(16)18-12(6-2)11(3)4/h5,11-12H,1,6-10H2,2-4H3
InChIKey ZVWULLAPTPTTEP-UHFFFAOYSA-N
Mol Weight 256.34 g/mol
Molecular Formula C14H24O4
Exact Mass 256.167459 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID D0OBBQREyTN
Name Succinic acid, 2-methylpent-3-yl but-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 256.167459249 u
Formula C14H24O4
InChI InChI=1S/C14H24O4/c1-5-7-10-17-13(15)8-9-14(16)18-12(6-2)11(3)4/h5,11-12H,1,6-10H2,2-4H3
InChIKey ZVWULLAPTPTTEP-UHFFFAOYSA-N
Molecular Weight 256.342 g/mol
SMILES C(CC(OC(CC)C(C)C)=O)C(OCCC=C)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.935595