![N-[2-(3-bromopropoxy)phenyl]-3,4,5,6-tetrahydrophthalimide](/api/spectrum/Ie4yhbJdwZA/structure.png?h=300&w=458 "N-[2-(3-bromopropoxy)phenyl]-3,4,5,6-tetrahydrophthalimide")
| SpectraBase Compound ID | G9icl3XCfGf |
|---|---|
| InChI | InChI=1S/C17H18BrNO3/c18-10-5-11-22-15-9-4-3-8-14(15)19-16(20)12-6-1-2-7-13(12)17(19)21/h3-4,8-9H,1-2,5-7,10-11H2 |
| InChIKey | HAZKRRAQZFHYSA-UHFFFAOYSA-N |
| Mol Weight | 364.24 g/mol |
| Molecular Formula | C17H18BrNO3 |
| Exact Mass | 363.047006 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Ie4yhbJdwZA |
|---|---|
| Name | N-[2-(3-Bromopropoxy)phenyl]-3,4,5,6-tetrahydrophthalimide |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 363.047006441 u |
| Formula | C17H18BrNO3 |
| InChI | InChI=1S/C17H18BrNO3/c18-10-5-11-22-15-9-4-3-8-14(15)19-16(20)12-6-1-2-7-13(12)17(19)21/h3-4,8-9H,1-2,5-7,10-11H2 |
| InChIKey | HAZKRRAQZFHYSA-UHFFFAOYSA-N |
| Molecular Weight | 364.239 g/mol |
| SMILES | C1(N(C(C=2CCCCC12)=O)c1c(OCCCBr)cccc1)=O |