![3-[4-(2,3-Dihydroxyphenyl)butyl]benzene-1,2-diol](/api/spectrum/CMEufuFIhm5/structure.png?h=300&w=458 "3-[4-(2,3-Dihydroxyphenyl)butyl]benzene-1,2-diol")
| SpectraBase Compound ID | DiCdaMb5Cez |
|---|---|
| InChI | InChI=1S/C16H18O4/c17-13-9-3-7-11(15(13)19)5-1-2-6-12-8-4-10-14(18)16(12)20/h3-4,7-10,17-20H,1-2,5-6H2 |
| InChIKey | CVTRVDLXKBSRMN-UHFFFAOYSA-N |
| Mol Weight | 274.32 g/mol |
| Molecular Formula | C16H18O4 |
| Exact Mass | 274.120509 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | CMEufuFIhm5 |
|---|---|
| Name | 3-[4-(2,3-Dihydroxyphenyl)butyl]benzene-1,2-diol |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 274.120509056 u |
| Formula | C16H18O4 |
| InChI | InChI=1S/C16H18O4/c17-13-9-3-7-11(15(13)19)5-1-2-6-12-8-4-10-14(18)16(12)20/h3-4,7-10,17-20H,1-2,5-6H2 |
| InChIKey | CVTRVDLXKBSRMN-UHFFFAOYSA-N |
| SMILES | C1(=C(O)C=CC=C1CCCCC=1C(=C(O)C=CC1)O)O |