| SpectraBase Compound ID | 9TZf5U30i9C |
|---|---|
| InChI | InChI=1S/C11H15BrO2/c12-7-3-6-11-5-2-1-4-9(11)8-14-10(11)13/h1-2,9H,3-8H2/t9-,11+/m0/s1 |
| InChIKey | XWIHMEJITDSDDL-GXSJLCMTSA-N |
| Mol Weight | 259.14 g/mol |
| Molecular Formula | C11H15BrO2 |
| Exact Mass | 258.025543 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 1cN0JKuH65o |
|---|---|
| Name | (3ARS,7ARS)-7A-(3-BROMOPROPYL)-3A,4,7,7A-TETRAHYDRO-ISOBENZOFURANONE |
| Compound Number | 4A |
| Copyright | Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| InChI | InChI=1S/C11H15BrO2/c12-7-3-6-11-5-2-1-4-9(11)8-14-10(11)13/h1-2,9H,3-8H2/t9-,11+/m0/s1 |
| InChIKey | XWIHMEJITDSDDL-GXSJLCMTSA-N |
| Literature Reference | C.DOSTAL,S.LAURITZ,E.URBAN HETEROCYCLES,34,135(1992) |
| Solvent | Chloroform-d |