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Trans-2-hydroxycinnamic acid, 3-methylbutyl ether, 3-methylbutyl ester
SpectraBase Compound ID CEZOV3CRMyK
InChI InChI=1S/C19H28O3/c1-15(2)11-13-21-18-8-6-5-7-17(18)9-10-19(20)22-14-12-16(3)4/h5-10,15-16H,11-14H2,1-4H3/b10-9+
InChIKey AFAVSKFVPWCOQW-MDZDMXLPSA-N
Mol Weight 304.43 g/mol
Molecular Formula C19H28O3
Exact Mass 304.203845 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JcLuqPwwJrn
Name Trans-2-hydroxycinnamic acid, 3-methylbutyl ether, 3-methylbutyl ester
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 304.203844759 u
Formula C19H28O3
InChI InChI=1S/C19H28O3/c1-15(2)11-13-21-18-8-6-5-7-17(18)9-10-19(20)22-14-12-16(3)4/h5-10,15-16H,11-14H2,1-4H3/b10-9+
InChIKey AFAVSKFVPWCOQW-MDZDMXLPSA-N
Molecular Weight 304.430 g/mol
SMILES C1(=CC=CC=C1\C=C\C(=O)OCCC(C)C)OCCC(C)C