| SpectraBase Compound ID | CMhCZ35HgHX |
|---|---|
| InChI | InChI=1S/C18H26O4/c1-6-7-10-21-17(20)18(5)9-8-14-13(4)15(19)11(2)12(3)16(14)22-18/h19H,6-10H2,1-5H3 |
| InChIKey | AJRDUSRFPIUOSL-UHFFFAOYSA-N |
| Mol Weight | 306.4 g/mol |
| Molecular Formula | C18H26O4 |
| Exact Mass | 306.183109 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | GsVlrZuCnfH |
|---|---|
| Name | 6-Hydroxy-2,5,7,8-tetramethylchroman-2-carboxylic acid. N-butyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 306.183109313 u |
| Formula | C18H26O4 |
| InChI | InChI=1S/C18H26O4/c1-6-7-10-21-17(20)18(5)9-8-14-13(4)15(19)11(2)12(3)16(14)22-18/h19H,6-10H2,1-5H3 |
| InChIKey | AJRDUSRFPIUOSL-UHFFFAOYSA-N |
| Molecular Weight | 306.402 g/mol |
| SMILES | CC1=C2OC(C)(CCC2=C(C(=C1C)O)C)C(=O)OCCCC |