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2-Propenoic acid, 1-methylundecyl ester

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

2-Propenoic acid, 1-methylundecyl ester
SpectraBase Compound ID 8mjXgeU5aAc
InChI InChI=1S/C15H28O2/c1-4-6-7-8-9-10-11-12-13-14(3)17-15(16)5-2/h5,14H,2,4,6-13H2,1,3H3
InChIKey XQACRXVFENATBU-UHFFFAOYSA-N
Mol Weight 240.39 g/mol
Molecular Formula C15H28O2
Exact Mass 240.20893 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID BTSwkxBujIe
Name 2-Propenoic acid, 1-methylundecyl ester
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 240.208930140 u
Formula C15H28O2
InChI InChI=1S/C15H28O2/c1-4-6-7-8-9-10-11-12-13-14(3)17-15(16)5-2/h5,14H,2,4,6-13H2,1,3H3
InChIKey XQACRXVFENATBU-UHFFFAOYSA-N
Molecular Weight 240.387 g/mol
SMILES C(CCCCCCCCCC)(OC(C=C)=O)C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.945798