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4-Pentenoic acid, 4-methoxycarbonyl-, isopropyl ester

View entire compound with spectra: 1 NMR, 1 FTIR, and 3 MS (GC)

4-Pentenoic acid, 4-methoxycarbonyl-, isopropyl ester
SpectraBase Compound ID EHygyMhVfFJ
InChI InChI=1S/C10H16O4/c1-7(2)14-9(11)6-5-8(3)10(12)13-4/h7H,3,5-6H2,1-2,4H3
InChIKey YVHKDBSIXCQVNN-UHFFFAOYSA-N
Mol Weight 200.23 g/mol
Molecular Formula C10H16O4
Exact Mass 200.104859 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 62Vl81BDEh1
Name 4-Pentenoic acid, 4-methoxycarbonyl-, isopropyl ester
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 200.104858991 u
Formula C10H16O4
InChI InChI=1S/C10H16O4/c1-7(2)14-9(11)6-5-8(3)10(12)13-4/h7H,3,5-6H2,1-2,4H3
InChIKey YVHKDBSIXCQVNN-UHFFFAOYSA-N
Molecular Weight 200.234 g/mol
SMILES C(=O)(OC)C(CCC(=O)OC(C)C)=C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.887642