| SpectraBase Compound ID | EUxnD3Y6y4f |
|---|---|
| InChI | InChI=1S/C17H21BrO4/c1-13(2)12-17(20)22-15-9-6-5-8-14(15)21-16(19)10-4-3-7-11-18/h5-6,8-9,12H,3-4,7,10-11H2,1-2H3 |
| InChIKey | RRERAIGHGKCTSX-UHFFFAOYSA-N |
| Mol Weight | 369.26 g/mol |
| Molecular Formula | C17H21BrO4 |
| Exact Mass | 368.062322 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | 3qTGDTLyFia |
|---|---|
| Name | 1,2-Benzenediol, o-(3-methylbut-2-enoyl)-o'-(6-bromohexanoyl)- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 368.062322152 u |
| Formula | C17H21BrO4 |
| InChI | InChI=1S/C17H21BrO4/c1-13(2)12-17(20)22-15-9-6-5-8-14(15)21-16(19)10-4-3-7-11-18/h5-6,8-9,12H,3-4,7,10-11H2,1-2H3 |
| InChIKey | RRERAIGHGKCTSX-UHFFFAOYSA-N |
| Molecular Weight | 369.255 g/mol |
| SMILES | C1(=CC=CC=C1OC(=O)C=C(C)C)OC(=O)CCCCCBr |