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4-(2-Butenyl)-5-hydroxy-m-anisic acid
SpectraBase Compound ID AU72S9pAhNc
InChI InChI=1S/C12H14O4/c1-3-4-5-9-10(13)6-8(12(14)15)7-11(9)16-2/h3-4,6-7,13H,5H2,1-2H3,(H,14,15)
InChIKey VENAAFUYLXNOEV-UHFFFAOYSA-N
Mol Weight 222.24 g/mol
Molecular Formula C12H14O4
Exact Mass 222.089209 g/mol

Raman Spectrum

Raman Spectrum

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SpectraBase Spectrum ID EJkl2E0P6i1
Name 4-(2-Butenyl)-5-hydroxy-m-anisic acid
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 222.089208927 u
Formula C12H14O4
InChI InChI=1S/C12H14O4/c1-3-4-5-9-10(13)6-8(12(14)15)7-11(9)16-2/h3-4,6-7,13H,5H2,1-2H3,(H,14,15)
InChIKey VENAAFUYLXNOEV-UHFFFAOYSA-N
Molecular Weight 222.240 g/mol
SMILES OC(C1=CC(=C(C(=C1)O)CC=CC)OC)=O
Spectrum/Structure Validation Score (Raman) 0.969839