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1-Butoxypropan-2-yl 2-methylbut-2-enoate

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

1-Butoxypropan-2-yl 2-methylbut-2-enoate
SpectraBase Compound ID EnQyMfoEdde
InChI InChI=1S/C12H22O3/c1-5-7-8-14-9-11(4)15-12(13)10(3)6-2/h6,11H,5,7-9H2,1-4H3/b10-6+
InChIKey ABGZVEDZGZMIJV-UXBLZVDNSA-N
Mol Weight 214.3 g/mol
Molecular Formula C12H22O3
Exact Mass 214.156895 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID DvSUQJBRTKG
Name 1-Butoxypropan-2-yl 2-methylbut-2-enoate
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 214.156894565 u
Formula C12H22O3
InChI InChI=1S/C12H22O3/c1-5-7-8-14-9-11(4)15-12(13)10(3)6-2/h6,11H,5,7-9H2,1-4H3/b10-6+
InChIKey ABGZVEDZGZMIJV-UXBLZVDNSA-N
Molecular Weight 214.305 g/mol
SMILES CCCCOCC(C)OC(\C(=C\C)C)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.979446