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2-Butenoic acid, 2-methyl-, 2-methylpropyl ester, (E)-

View entire compound with spectra: 2 NMR, 3 FTIR, and 7 MS (GC)

2-Butenoic acid, 2-methyl-, 2-methylpropyl ester, (E)-
SpectraBase Compound ID 7rMN04MhBjA
InChI InChI=1S/C9H16O2/c1-5-8(4)9(10)11-6-7(2)3/h5,7H,6H2,1-4H3/b8-5+
InChIKey XDEGQMQKHFPBEW-VMPITWQZSA-N
Mol Weight 156.22 g/mol
Molecular Formula C9H16O2
Exact Mass 156.11503 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID EoiFExjmtou
Name Isobutyl tiglate
Source of Sample Sigma-Aldrich Co. LLC.
Catalog Number W500704
CAS Registry Number 61692-84-0
Copyright Copyright © 2021-2024 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2021 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H16O2
InChI InChI=1S/C9H16O2/c1-5-8(4)9(10)11-6-7(2)3/h5,7H,6H2,1-4H3/b8-5+
InChIKey XDEGQMQKHFPBEW-VMPITWQZSA-N
Observed nucleus 1H
Purity >=98%
Solvent CDCl3
Source of Spectrum Sigma-Aldrich Co. LLC.
Wiley ID SIAL_1HNMR_013145