| SpectraBase Compound ID | 8li6096U4Pw |
|---|---|
| InChI | InChI=1S/C9H12BrNO2/c1-9(2,3)13-8(12)11-6-4-5-7(11)10/h4-6H,1-3H3 |
| InChIKey | HMQSOVFFDHSOMX-UHFFFAOYSA-N |
| Mol Weight | 246.1 g/mol |
| Molecular Formula | C9H12BrNO2 |
| Exact Mass | 245.005142 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 3rJRQuCIsbY |
|---|---|
| Name | N-PYRROLECARBOXYLIC ACID, 2-BROMO-, tert--BUTYL ESTER |
| Copyright | Copyright © 2002-2025 Wiley-VCH GmbH. All Rights Reserved. |
| Formula | C9H12BrNO2 |
| InChI | InChI=1S/C9H12BrNO2/c1-9(2,3)13-8(12)11-6-4-5-7(11)10/h4-6H,1-3H3 |
| InChIKey | HMQSOVFFDHSOMX-UHFFFAOYSA-N |
| Molecular Weight | 245.0048 |
| SMILES | c1c[n](C(OC(C)(C)C)=O)c(Br)c1 |
| SPLASH | splash10-0a4m-9300000000-fe1ad36742f130f1a39f |
| Source of Spectrum | Chemical Concepts, A Wiley Division, Weinheim, Germany |